vgo_24_formula

id
C
H
O
N
S
DBE
molecular_weight
mass fraction_wtpct
compound type
1 11 18 0 0 0 3 150.144 0.014816 Saturates
2 11 20 0 0 0 2 152.16 0.014039 Saturates
3 11 22 0 0 0 1 154.176 0.010681 Saturates
4 12 20 0 0 0 3 164.16 0.021665 Saturates
5 12 22 0 0 0 2 166.176 0.025745 Saturates
6 12 24 0 0 0 1 168.192 0.016491 Saturates
7 12 26 0 0 0 0 170.208 0.003698 Saturates
8 13 20 0 0 0 4 176.16 0.009767 Saturates
9 13 22 0 0 0 3 178.176 0.06088 Saturates
10 13 24 0 0 0 2 180.192 0.076438 Saturates
11 13 26 0 0 0 1 182.208 0.042299 Saturates
12 13 28 0 0 0 0 184.224 0.009044 Saturates
13 14 22 0 0 0 4 190.176 0.027988 Saturates
14 14 24 0 0 0 3 192.192 0.126093 Saturates
15 14 26 0 0 0 2 194.208 0.188087 Saturates
16 14 28 0 0 0 1 196.224 0.063414 Saturates
17 14 30 0 0 0 0 198.24 0.017349 Saturates
18 15 22 0 0 0 5 202.176 0.016175 Saturates
19 15 24 0 0 0 4 204.192 0.077691 Saturates
20 15 26 0 0 0 3 206.208 0.253469 Saturates
21 15 28 0 0 0 2 208.224 0.478826 Saturates
22 15 30 0 0 0 1 210.24 0.116469 Saturates
23 15 32 0 0 0 0 212.256 0.033913 Saturates
24 16 22 0 0 0 6 214.176 0.026071 Saturates
25 16 24 0 0 0 5 216.192 0.051845 Saturates
26 16 26 0 0 0 4 218.208 0.192287 Saturates
27 16 28 0 0 0 3 220.224 0.450041 Saturates
28 16 30 0 0 0 2 222.24 0.643226 Saturates
29 16 32 0 0 0 1 224.256 0.228261 Saturates
30 16 34 0 0 0 0 226.272 0.064924 Saturates
31 17 24 0 0 0 6 228.192 0.069937 Saturates
32 17 26 0 0 0 5 230.208 0.133013 Saturates
33 17 28 0 0 0 4 232.224 0.337569 Saturates
34 17 30 0 0 0 3 234.24 0.742605 Saturates
35 17 32 0 0 0 2 236.256 0.75057 Saturates
36 17 34 0 0 0 1 238.272 0.353726 Saturates
37 17 36 0 0 0 0 240.288 0.115049 Saturates
38 18 26 0 0 0 6 242.208 0.153912 Saturates
39 18 28 0 0 0 5 244.224 0.273194 Saturates
40 18 30 0 0 0 4 246.24 0.534185 Saturates
41 18 32 0 0 0 3 248.256 1.14983 Saturates
42 18 34 0 0 0 2 250.272 1.19638 Saturates
43 18 36 0 0 0 1 252.288 0.626858 Saturates
44 18 38 0 0 0 0 254.304 0.202352 Saturates
45 19 28 0 0 0 6 256.224 0.247139 Saturates
46 19 30 0 0 0 5 258.24 0.422505 Saturates
47 19 32 0 0 0 4 260.256 0.8958 Saturates
48 19 34 0 0 0 3 262.272 1.73721 Saturates
49 19 36 0 0 0 2 264.288 1.91739 Saturates
50 19 38 0 0 0 1 266.304 0.891194 Saturates
51 19 40 0 0 0 0 268.32 0.319412 Saturates
52 20 30 0 0 0 6 270.24 0.325802 Saturates
53 20 32 0 0 0 5 272.256 0.541575 Saturates
54 20 34 0 0 0 4 274.272 1.08931 Saturates
55 20 36 0 0 0 3 276.288 1.77339 Saturates
56 20 38 0 0 0 2 278.304 2.38543 Saturates
57 20 40 0 0 0 1 280.32 1.05214 Saturates
58 20 42 0 0 0 0 282.336 0.416037 Saturates
59 21 32 0 0 0 6 284.256 0.359769 Saturates
60 21 34 0 0 0 5 286.272 0.591236 Saturates
61 21 36 0 0 0 4 288.288 1.10042 Saturates
62 21 38 0 0 0 3 290.304 1.52501 Saturates
63 21 40 0 0 0 2 292.32 2.75348 Saturates
64 21 42 0 0 0 1 294.336 1.09736 Saturates
65 21 44 0 0 0 0 296.352 0.390748 Saturates
66 22 34 0 0 0 6 298.272 0.342141 Saturates
67 22 36 0 0 0 5 300.288 0.544947 Saturates
68 22 38 0 0 0 4 302.304 0.993906 Saturates
69 22 40 0 0 0 3 304.32 1.06955 Saturates
70 22 42 0 0 0 2 306.336 1.74597 Saturates
71 22 44 0 0 0 1 308.352 0.962016 Saturates
72 22 46 0 0 0 0 310.368 0.344929 Saturates
73 23 36 0 0 0 6 312.288 0.25899 Saturates
74 23 38 0 0 0 5 314.304 0.403114 Saturates
75 23 40 0 0 0 4 316.32 0.68485 Saturates
76 23 42 0 0 0 3 318.336 0.854753 Saturates
77 23 44 0 0 0 2 320.352 0.992741 Saturates
78 23 46 0 0 0 1 322.368 0.770145 Saturates
79 23 48 0 0 0 0 324.384 0.264464 Saturates
80 24 38 0 0 0 6 326.304 0.20883 Saturates
81 24 40 0 0 0 5 328.32 0.328088 Saturates
82 24 42 0 0 0 4 330.336 0.46374 Saturates
83 24 44 0 0 0 3 332.352 0.630115 Saturates
84 24 46 0 0 0 2 334.368 0.704672 Saturates
85 24 48 0 0 0 1 336.384 0.56345 Saturates
86 24 50 0 0 0 0 338.4 0.178738 Saturates
87 25 40 0 0 0 6 340.32 0.137425 Saturates
88 25 42 0 0 0 5 342.336 0.18748 Saturates
89 25 44 0 0 0 4 344.352 0.257769 Saturates
90 25 46 0 0 0 3 346.368 0.36396 Saturates
91 25 48 0 0 0 2 348.384 0.422463 Saturates
92 25 50 0 0 0 1 350.4 0.346285 Saturates
93 25 52 0 0 0 0 352.416 0.112003 Saturates
94 26 42 0 0 0 6 354.336 0.082227 Saturates
95 26 44 0 0 0 5 356.352 0.112647 Saturates
96 26 46 0 0 0 4 358.368 0.158584 Saturates
97 26 48 0 0 0 3 360.384 0.198328 Saturates
98 26 50 0 0 0 2 362.4 0.228089 Saturates
99 26 52 0 0 0 1 364.416 0.189349 Saturates
100 26 54 0 0 0 0 366.432 0.059196 Saturates
101 27 44 0 0 0 6 368.352 0.049245 Saturates
102 27 46 0 0 0 5 370.368 0.069953 Saturates
103 27 48 0 0 0 4 372.384 0.128305 Saturates
104 27 50 0 0 0 3 374.4 0.11446 Saturates
105 27 52 0 0 0 2 376.416 0.110181 Saturates
106 27 54 0 0 0 1 378.432 0.093299 Saturates
107 27 56 0 0 0 0 380.448 0.033203 Saturates
108 28 46 0 0 0 6 382.368 0.024699 Saturates
109 28 48 0 0 0 5 384.384 0.031344 Saturates
110 28 50 0 0 0 4 386.4 0.050014 Saturates
111 28 52 0 0 0 3 388.416 0.051416 Saturates
112 28 54 0 0 0 2 390.432 0.053609 Saturates
113 28 56 0 0 0 1 392.448 0.046658 Saturates
114 28 58 0 0 0 0 394.464 0.015706 Saturates
115 29 48 0 0 0 6 396.384 0.010038 Saturates
116 29 50 0 0 0 5 398.4 0.018457 Saturates
117 29 52 0 0 0 4 400.416 0.030023 Saturates
118 29 54 0 0 0 3 402.432 0.026197 Saturates
119 29 56 0 0 0 2 404.448 0.024779 Saturates
120 29 58 0 0 0 1 406.464 0.021885 Saturates
121 30 56 0 0 0 3 416.448 0.011082 Saturates
122 30 60 0 0 0 1 420.48 0.017351 Saturates
123 30 62 0 0 0 0 422.496 0.087813 Saturates
124 11 10 0 0 0 7 142.08 0.002927 Aromatics
125 11 14 0 0 0 5 146.112 0.003279 Aromatics
126 11 10 0 0 0 7 142.08 0.008238 Aromatics
127 12 12 0 0 0 7 156.096 0.056493 Aromatics
128 12 14 0 0 0 6 158.112 0.003718 Aromatics
129 12 16 0 0 0 5 160.128 0.015247 Aromatics
130 12 18 0 0 0 4 162.144 0.00498 Aromatics
131 12 10 0 0 0 8 154.08 0.004084 Aromatics
132 12 12 0 0 0 7 156.096 0.031729 Aromatics
133 12 14 0 0 0 6 158.112 0.00473 Aromatics
134 12 16 0 0 0 5 160.128 0.005783 Aromatics
135 13 10 0 0 0 9 166.08 0.010039 Aromatics
136 13 12 0 0 0 8 168.096 0.021882 Aromatics
137 13 14 0 0 0 7 170.112 0.231173 Aromatics
138 13 16 0 0 0 6 172.128 0.018771 Aromatics
139 13 18 0 0 0 5 174.144 0.04113 Aromatics
140 13 20 0 0 0 4 176.16 0.007248 Aromatics
141 13 8 0 0 0 10 164.064 0.005346 Aromatics
142 13 10 0 0 0 9 166.08 0.017594 Aromatics
143 13 12 0 0 0 8 168.096 0.02295 Aromatics
144 13 14 0 0 0 7 170.112 0.057688 Aromatics
145 13 16 0 0 0 6 172.128 0.01272 Aromatics
146 13 18 0 0 0 5 174.144 0.01632 Aromatics
147 13 20 0 0 0 4 176.16 0.004615 Aromatics
148 14 8 0 0 0 11 176.064 0.006307 Aromatics
149 14 10 0 0 0 10 178.08 0.031174 Aromatics
150 14 12 0 0 0 9 180.096 0.09038 Aromatics
151 14 14 0 0 0 8 182.112 0.150096 Aromatics
152 14 16 0 0 0 7 184.128 0.389083 Aromatics
153 14 18 0 0 0 6 186.144 0.076984 Aromatics
154 14 20 0 0 0 5 188.16 0.100055 Aromatics
155 14 22 0 0 0 4 190.176 0.017029 Aromatics
156 14 10 0 0 0 10 178.08 0.033735 Aromatics
157 14 12 0 0 0 9 180.096 0.062829 Aromatics
158 14 14 0 0 0 8 182.112 0.077018 Aromatics
159 14 16 0 0 0 7 184.128 0.058834 Aromatics
160 14 18 0 0 0 6 186.144 0.036984 Aromatics
161 14 20 0 0 0 5 188.16 0.030439 Aromatics
162 14 22 0 0 0 4 190.176 0.007306 Aromatics
163 15 4 0 0 0 14 184.032 0.002991 Aromatics
164 15 10 0 0 0 11 190.08 0.014801 Aromatics
165 15 12 0 0 0 10 192.096 0.206746 Aromatics
166 15 14 0 0 0 9 194.112 0.284501 Aromatics
167 15 16 0 0 0 8 196.128 0.494275 Aromatics
168 15 18 0 0 0 7 198.144 0.357967 Aromatics
169 15 4 0 0 0 14 184.032 0.003454 Aromatics
170 15 20 0 0 0 6 200.16 0.226656 Aromatics
171 15 22 0 0 0 5 202.176 0.195391 Aromatics
172 15 24 0 0 0 4 204.192 0.040416 Aromatics
173 15 10 0 0 0 11 190.08 0.008235 Aromatics
174 15 12 0 0 0 10 192.096 0.077584 Aromatics
175 15 14 0 0 0 9 194.112 0.114907 Aromatics
176 15 16 0 0 0 8 196.128 0.159202 Aromatics
177 15 18 0 0 0 7 198.144 0.078466 Aromatics
178 15 20 0 0 0 6 200.16 0.080412 Aromatics
179 15 22 0 0 0 5 202.176 0.046917 Aromatics
180 15 24 0 0 0 4 204.192 0.013586 Aromatics
181 16 6 0 0 0 14 198.048 0.024808 Aromatics
182 16 10 0 0 0 12 202.08 0.012799 Aromatics
183 16 12 0 0 0 11 204.096 0.041413 Aromatics
184 16 14 0 0 0 10 206.112 0.423822 Aromatics
185 16 16 0 0 0 9 208.128 0.458689 Aromatics
186 16 18 0 0 0 8 210.144 0.939757 Aromatics
187 16 20 0 0 0 7 212.16 0.432447 Aromatics
188 16 6 0 0 0 14 198.048 0.012367 Aromatics
189 16 22 0 0 0 6 214.176 0.463654 Aromatics
190 16 24 0 0 0 5 216.192 0.277364 Aromatics
191 16 10 0 0 0 12 202.08 0.008289 Aromatics
192 16 26 0 0 0 4 218.208 0.072722 Aromatics
193 16 12 0 0 0 11 204.096 0.021337 Aromatics
194 16 14 0 0 0 10 206.112 0.086585 Aromatics
195 16 16 0 0 0 9 208.128 0.154575 Aromatics
196 16 18 0 0 0 8 210.144 0.2359 Aromatics
197 16 20 0 0 0 7 212.16 0.111286 Aromatics
198 16 22 0 0 0 6 214.176 0.119824 Aromatics
199 16 24 0 0 0 5 216.192 0.063224 Aromatics
200 16 26 0 0 0 4 218.208 0.020708 Aromatics
201 17 8 0 0 0 14 212.064 0.075818 Aromatics
202 17 10 0 0 0 13 214.08 0.005751 Aromatics
203 17 12 0 0 0 12 216.096 0.043848 Aromatics
204 17 14 0 0 0 11 218.112 0.116282 Aromatics
205 17 16 0 0 0 10 220.128 0.385721 Aromatics
206 17 18 0 0 0 9 222.144 0.644847 Aromatics
207 17 20 0 0 0 8 224.16 1.30257 Aromatics
208 17 22 0 0 0 7 226.176 0.590359 Aromatics
209 17 8 0 0 0 14 212.064 0.013876 Aromatics
210 17 24 0 0 0 6 228.192 0.644782 Aromatics
211 17 26 0 0 0 5 230.208 0.350084 Aromatics
212 17 12 0 0 0 12 216.096 0.013779 Aromatics
213 17 28 0 0 0 4 232.224 0.111579 Aromatics
214 17 14 0 0 0 11 218.112 0.039258 Aromatics
215 17 16 0 0 0 10 220.128 0.074899 Aromatics
216 17 18 0 0 0 9 222.144 0.196376 Aromatics
217 17 20 0 0 0 8 224.16 0.274169 Aromatics
218 17 22 0 0 0 7 226.176 0.147083 Aromatics
219 17 24 0 0 0 6 228.192 0.147068 Aromatics
220 17 26 0 0 0 5 230.208 0.087331 Aromatics
221 17 28 0 0 0 4 232.224 0.029021 Aromatics
222 18 10 0 0 0 14 226.08 0.073302 Aromatics
223 18 12 0 0 0 13 228.096 0.01239 Aromatics
224 18 14 0 0 0 12 230.112 0.075198 Aromatics
225 18 16 0 0 0 11 232.128 0.190428 Aromatics
226 18 18 0 0 0 10 234.144 0.312371 Aromatics
227 18 20 0 0 0 9 236.16 0.876033 Aromatics
228 18 22 0 0 0 8 238.176 1.40005 Aromatics
229 18 24 0 0 0 7 240.192 0.733285 Aromatics
230 18 10 0 0 0 14 226.08 0.013327 Aromatics
231 18 26 0 0 0 6 242.208 0.745117 Aromatics
232 18 28 0 0 0 5 244.224 0.455858 Aromatics
233 18 14 0 0 0 12 230.112 0.016248 Aromatics
234 18 30 0 0 0 4 246.24 0.149687 Aromatics
235 18 16 0 0 0 11 232.128 0.042092 Aromatics
236 18 18 0 0 0 10 234.144 0.07595 Aromatics
237 18 20 0 0 0 9 236.16 0.198332 Aromatics
238 18 22 0 0 0 8 238.176 0.243309 Aromatics
239 18 24 0 0 0 7 240.192 0.171816 Aromatics
240 18 26 0 0 0 6 242.208 0.154104 Aromatics
241 18 28 0 0 0 5 244.224 0.106995 Aromatics
242 18 30 0 0 0 4 246.24 0.039038 Aromatics
243 19 12 0 0 0 14 240.096 0.052103 Aromatics
244 19 14 0 0 0 13 242.112 0.021926 Aromatics
245 19 16 0 0 0 12 244.128 0.076012 Aromatics
246 19 18 0 0 0 11 246.144 0.202276 Aromatics
247 19 20 0 0 0 10 248.16 0.283385 Aromatics
248 19 22 0 0 0 9 250.176 0.867269 Aromatics
249 19 24 0 0 0 8 252.192 1.1376 Aromatics
250 19 26 0 0 0 7 254.208 0.801466 Aromatics
251 19 12 0 0 0 14 240.096 0.006866 Aromatics
252 19 28 0 0 0 6 256.224 0.745686 Aromatics
253 19 14 0 0 0 13 242.112 0.005031 Aromatics
254 19 30 0 0 0 5 258.24 0.532932 Aromatics
255 19 16 0 0 0 12 244.128 0.015489 Aromatics
256 19 32 0 0 0 4 260.256 0.186897 Aromatics
257 19 18 0 0 0 11 246.144 0.036653 Aromatics
258 19 20 0 0 0 10 248.16 0.064944 Aromatics
259 19 22 0 0 0 9 250.176 0.159958 Aromatics
260 19 24 0 0 0 8 252.192 0.177734 Aromatics
261 19 26 0 0 0 7 254.208 0.171328 Aromatics
262 19 28 0 0 0 6 256.224 0.151606 Aromatics
263 19 30 0 0 0 5 258.24 0.123316 Aromatics
264 19 32 0 0 0 4 260.256 0.044493 Aromatics
265 20 14 0 0 0 14 254.112 0.031221 Aromatics
266 20 16 0 0 0 13 256.128 0.025834 Aromatics
267 20 18 0 0 0 12 258.144 0.072591 Aromatics
268 20 20 0 0 0 11 260.16 0.159946 Aromatics
269 20 22 0 0 0 10 262.176 0.238792 Aromatics
270 20 24 0 0 0 9 264.192 0.667403 Aromatics
271 20 26 0 0 0 8 266.208 0.769886 Aromatics
272 20 28 0 0 0 7 268.224 0.745542 Aromatics
273 20 30 0 0 0 6 270.24 0.68428 Aromatics
274 20 16 0 0 0 13 256.128 0.006585 Aromatics
275 20 32 0 0 0 5 272.256 0.573614 Aromatics
276 20 18 0 0 0 12 258.144 0.014952 Aromatics
277 20 34 0 0 0 4 274.272 0.208036 Aromatics
278 20 20 0 0 0 11 260.16 0.027135 Aromatics
279 20 22 0 0 0 10 262.176 0.049664 Aromatics
280 20 24 0 0 0 9 264.192 0.111182 Aromatics
281 20 26 0 0 0 8 266.208 0.130975 Aromatics
282 20 28 0 0 0 7 268.224 0.145073 Aromatics
283 20 30 0 0 0 6 270.24 0.132933 Aromatics
284 20 32 0 0 0 5 272.256 0.126039 Aromatics
285 20 34 0 0 0 4 274.272 0.048985 Aromatics
286 21 16 0 0 0 14 268.128 0.015139 Aromatics
287 21 18 0 0 0 13 270.144 0.025598 Aromatics
288 21 20 0 0 0 12 272.16 0.06543 Aromatics
289 21 22 0 0 0 11 274.176 0.113148 Aromatics
290 21 24 0 0 0 10 276.192 0.173772 Aromatics
291 21 26 0 0 0 9 278.208 0.441539 Aromatics
292 21 28 0 0 0 8 280.224 0.536854 Aromatics
293 21 30 0 0 0 7 282.24 0.598364 Aromatics
294 21 32 0 0 0 6 284.256 0.56849 Aromatics
295 21 34 0 0 0 5 286.272 0.548915 Aromatics
296 21 20 0 0 0 12 272.16 0.008471 Aromatics
297 21 36 0 0 0 4 288.288 0.208991 Aromatics
298 21 22 0 0 0 11 274.176 0.016937 Aromatics
299 21 24 0 0 0 10 276.192 0.030996 Aromatics
300 21 26 0 0 0 9 278.208 0.068161 Aromatics
301 21 28 0 0 0 8 280.224 0.082781 Aromatics
302 21 30 0 0 0 7 282.24 0.112011 Aromatics
303 21 32 0 0 0 6 284.256 0.109836 Aromatics
304 21 34 0 0 0 5 286.272 0.101391 Aromatics
305 21 36 0 0 0 4 288.288 0.042365 Aromatics
306 22 20 0 0 0 13 284.16 0.016495 Aromatics
307 22 22 0 0 0 12 286.176 0.041423 Aromatics
308 22 24 0 0 0 11 288.192 0.070654 Aromatics
309 22 26 0 0 0 10 290.208 0.115937 Aromatics
310 22 28 0 0 0 9 292.224 0.261337 Aromatics
311 22 30 0 0 0 8 294.24 0.326249 Aromatics
312 22 32 0 0 0 7 296.256 0.442731 Aromatics
313 22 34 0 0 0 6 298.272 0.440019 Aromatics
314 22 36 0 0 0 5 300.288 0.427119 Aromatics
315 22 38 0 0 0 4 302.304 0.182212 Aromatics
316 22 24 0 0 0 11 288.192 0.011001 Aromatics
317 22 26 0 0 0 10 290.208 0.021917 Aromatics
318 22 28 0 0 0 9 292.224 0.039792 Aromatics
319 22 30 0 0 0 8 294.24 0.050323 Aromatics
320 22 32 0 0 0 7 296.256 0.071318 Aromatics
321 22 34 0 0 0 6 298.272 0.06869 Aromatics
322 22 36 0 0 0 5 300.288 0.069344 Aromatics
323 22 38 0 0 0 4 302.304 0.034419 Aromatics
324 23 20 0 0 0 14 296.16 0.006385 Aromatics
325 23 22 0 0 0 13 298.176 0.014772 Aromatics
326 23 24 0 0 0 12 300.192 0.02743 Aromatics
327 23 26 0 0 0 11 302.208 0.040731 Aromatics
328 23 28 0 0 0 10 304.224 0.072904 Aromatics
329 23 30 0 0 0 9 306.24 0.145136 Aromatics
330 23 32 0 0 0 8 308.256 0.186423 Aromatics
331 23 34 0 0 0 7 310.272 0.252547 Aromatics
332 23 36 0 0 0 6 312.288 0.27111 Aromatics
333 23 38 0 0 0 5 314.304 0.25747 Aromatics
334 23 40 0 0 0 4 316.32 0.135697 Aromatics
335 23 26 0 0 0 11 302.208 0.00439 Aromatics
336 23 28 0 0 0 10 304.224 0.013732 Aromatics
337 23 30 0 0 0 9 306.24 0.020852 Aromatics
338 23 32 0 0 0 8 308.256 0.033981 Aromatics
339 23 34 0 0 0 7 310.272 0.040818 Aromatics
340 23 36 0 0 0 6 312.288 0.045572 Aromatics
341 23 38 0 0 0 5 314.304 0.045721 Aromatics
342 23 40 0 0 0 4 316.32 0.022368 Aromatics
343 24 26 0 0 0 12 314.208 0.015265 Aromatics
344 24 28 0 0 0 11 316.224 0.021411 Aromatics
345 24 30 0 0 0 10 318.24 0.043098 Aromatics
346 24 32 0 0 0 9 320.256 0.078059 Aromatics
347 24 34 0 0 0 8 322.272 0.111731 Aromatics
348 24 36 0 0 0 7 324.288 0.150494 Aromatics
349 24 38 0 0 0 6 326.304 0.171409 Aromatics
350 24 40 0 0 0 5 328.32 0.169131 Aromatics
351 24 42 0 0 0 4 330.336 0.083851 Aromatics
352 24 30 0 0 0 10 318.24 0.009956 Aromatics
353 24 32 0 0 0 9 320.256 0.01202 Aromatics
354 24 34 0 0 0 8 322.272 0.017953 Aromatics
355 24 36 0 0 0 7 324.288 0.025784 Aromatics
356 24 38 0 0 0 6 326.304 0.025248 Aromatics
357 24 40 0 0 0 5 328.32 0.02178 Aromatics
358 24 42 0 0 0 4 330.336 0.01241 Aromatics
359 24 42 0 0 0 4 330.336 0.013289 Aromatics
360 25 28 0 0 0 12 328.224 0.008963 Aromatics
361 25 30 0 0 0 11 330.24 0.012629 Aromatics
362 25 32 0 0 0 10 332.256 0.022815 Aromatics
363 25 34 0 0 0 9 334.272 0.045254 Aromatics
364 25 36 0 0 0 8 336.288 0.05554 Aromatics
365 25 38 0 0 0 7 338.304 0.075145 Aromatics
366 25 40 0 0 0 6 340.32 0.084615 Aromatics
367 25 42 0 0 0 5 342.336 0.080709 Aromatics
368 25 44 0 0 0 4 344.352 0.045974 Aromatics
369 25 36 0 0 0 8 336.288 0.008666 Aromatics
370 25 38 0 0 0 7 338.304 0.012259 Aromatics
371 25 40 0 0 0 6 340.32 0.011584 Aromatics
372 25 42 0 0 0 5 342.336 0.010016 Aromatics
373 25 42 0 0 0 5 342.336 0.023988 Aromatics
374 26 34 0 0 0 10 346.272 0.012494 Aromatics
375 26 36 0 0 0 9 348.288 0.022708 Aromatics
376 26 38 0 0 0 8 350.304 0.028258 Aromatics
377 26 40 0 0 0 7 352.32 0.034041 Aromatics
378 26 42 0 0 0 6 354.336 0.041874 Aromatics
379 26 44 0 0 0 5 356.352 0.038981 Aromatics
380 26 40 0 0 0 7 352.32 0.017872 Aromatics
381 26 42 0 0 0 6 354.336 0.006251 Aromatics
382 27 36 0 0 0 10 360.288 0.00752 Aromatics
383 27 38 0 0 0 9 362.304 0.011808 Aromatics
384 27 40 0 0 0 8 364.32 0.014653 Aromatics
385 27 42 0 0 0 7 366.336 0.020935 Aromatics
386 27 46 0 0 0 5 370.368 0.015363 Aromatics
387 27 48 0 0 0 4 372.384 0.006858 Aromatics
388 37 48 0 0 0 14 492.384 0.011891 Aromatics
389 10 13 2 1 0 5 179.114 0.00039 Neutral nitrogen compounds
390 11 13 0 1 0 6 159.114 0.000317 Neutral nitrogen compounds
391 13 13 0 1 0 8 183.114 0.000343 Neutral nitrogen compounds
392 14 13 0 1 0 9 195.114 0.068842 Neutral nitrogen compounds
393 15 13 0 1 0 10 207.114 0.004064 Neutral nitrogen compounds
394 16 13 0 1 0 11 219.114 0.000933 Neutral nitrogen compounds
395 17 13 0 1 0 12 231.114 0.023932 Neutral nitrogen compounds
396 18 13 0 1 0 13 243.114 0.00099 Neutral nitrogen compounds
397 20 13 0 1 0 15 267.114 0.000705 Neutral nitrogen compounds
398 13 14 0 2 0 8 198.132 0.000363 Neutral nitrogen compounds
399 14 14 0 2 0 9 210.132 0.000458 Neutral nitrogen compounds
400 17 14 0 2 0 12 246.132 0.000991 Neutral nitrogen compounds
401 13 15 1 1 0 7 201.13 0.001141 Neutral nitrogen compounds
402 14 15 1 1 0 8 213.13 0.000523 Neutral nitrogen compounds
403 16 15 1 1 0 10 237.13 0.000896 Neutral nitrogen compounds
404 11 15 2 1 0 5 193.13 0.000471 Neutral nitrogen compounds
405 12 15 0 1 0 6 173.13 0.000323 Neutral nitrogen compounds
406 14 15 0 1 0 8 197.13 0.000402 Neutral nitrogen compounds
407 15 15 0 1 0 9 209.13 0.203706 Neutral nitrogen compounds
408 16 15 0 1 0 10 221.13 0.012511 Neutral nitrogen compounds
409 17 15 0 1 0 11 233.13 0.002303 Neutral nitrogen compounds
410 18 15 0 1 0 12 245.13 0.038905 Neutral nitrogen compounds
411 19 15 0 1 0 13 257.13 0.002418 Neutral nitrogen compounds
412 20 15 0 1 0 14 269.13 0.000865 Neutral nitrogen compounds
413 21 15 0 1 0 15 281.13 0.004302 Neutral nitrogen compounds
414 15 16 0 2 0 9 224.148 0.000913 Neutral nitrogen compounds
415 18 16 0 2 0 12 260.148 0.001314 Neutral nitrogen compounds
416 14 17 1 1 0 7 215.146 0.0009 Neutral nitrogen compounds
417 15 17 1 1 0 8 227.146 0.000714 Neutral nitrogen compounds
418 16 17 1 1 0 9 239.146 0.000697 Neutral nitrogen compounds
419 17 17 1 1 0 10 251.146 0.001025 Neutral nitrogen compounds
420 13 17 0 1 0 6 187.146 0.000647 Neutral nitrogen compounds
421 14 17 0 1 0 7 199.146 0.001803 Neutral nitrogen compounds
422 15 17 0 1 0 8 211.146 0.00155 Neutral nitrogen compounds
423 16 17 0 1 0 9 223.146 0.293524 Neutral nitrogen compounds
424 17 17 0 1 0 10 235.146 0.038182 Neutral nitrogen compounds
425 18 17 0 1 0 11 247.146 0.003442 Neutral nitrogen compounds
426 19 17 0 1 0 12 259.146 0.025564 Neutral nitrogen compounds
427 20 17 0 1 0 13 271.146 0.006868 Neutral nitrogen compounds
428 21 17 0 1 0 14 283.146 0.00158 Neutral nitrogen compounds
429 22 17 0 1 0 15 295.146 0.006387 Neutral nitrogen compounds
430 23 17 0 1 0 16 307.146 0.001131 Neutral nitrogen compounds
431 16 18 0 2 0 9 238.164 0.001603 Neutral nitrogen compounds
432 19 18 0 2 0 12 274.164 0.001377 Neutral nitrogen compounds
433 15 19 1 1 0 7 229.162 0.002214 Neutral nitrogen compounds
434 16 19 1 1 0 8 241.162 0.001418 Neutral nitrogen compounds
435 17 19 1 1 0 9 253.162 0.000979 Neutral nitrogen compounds
436 18 19 1 1 0 10 265.162 0.001505 Neutral nitrogen compounds
437 19 19 1 1 0 11 277.162 0.00095 Neutral nitrogen compounds
438 20 19 1 1 0 12 289.162 0.000699 Neutral nitrogen compounds
439 14 19 0 1 0 6 201.162 0.001307 Neutral nitrogen compounds
440 15 19 0 1 0 7 213.162 0.004412 Neutral nitrogen compounds
441 16 19 0 1 0 8 225.162 0.008703 Neutral nitrogen compounds
442 17 19 0 1 0 9 237.162 0.327299 Neutral nitrogen compounds
443 18 19 0 1 0 10 249.162 0.070543 Neutral nitrogen compounds
444 19 19 0 1 0 11 261.162 0.00483 Neutral nitrogen compounds
445 20 19 0 1 0 12 273.162 0.009895 Neutral nitrogen compounds
446 21 19 0 1 0 13 285.162 0.011247 Neutral nitrogen compounds
447 22 19 0 1 0 14 297.162 0.00263 Neutral nitrogen compounds
448 23 19 0 1 0 15 309.162 0.005087 Neutral nitrogen compounds
449 24 19 0 1 0 16 321.162 0.001059 Neutral nitrogen compounds
450 17 20 0 2 0 9 252.18 0.001342 Neutral nitrogen compounds
451 20 20 0 2 0 12 288.18 0.001373 Neutral nitrogen compounds
452 16 21 1 1 0 7 243.178 0.00248 Neutral nitrogen compounds
453 17 21 1 1 0 8 255.178 0.001178 Neutral nitrogen compounds
454 18 21 1 1 0 9 267.178 0.000611 Neutral nitrogen compounds
455 19 21 1 1 0 10 279.178 0.001699 Neutral nitrogen compounds
456 20 21 1 1 0 11 291.178 0.00134 Neutral nitrogen compounds
457 21 21 1 1 0 12 303.178 0.00066 Neutral nitrogen compounds
458 15 21 0 1 0 6 215.178 0.002183 Neutral nitrogen compounds
459 16 21 0 1 0 7 227.178 0.013734 Neutral nitrogen compounds
460 17 21 0 1 0 8 239.178 0.022282 Neutral nitrogen compounds
461 18 21 0 1 0 9 251.178 0.222549 Neutral nitrogen compounds
462 19 21 0 1 0 10 263.178 0.062022 Neutral nitrogen compounds
463 20 21 0 1 0 11 275.178 0.009134 Neutral nitrogen compounds
464 21 21 0 1 0 12 287.178 0.019264 Neutral nitrogen compounds
465 22 21 0 1 0 13 299.178 0.013118 Neutral nitrogen compounds
466 23 21 0 1 0 14 311.178 0.002521 Neutral nitrogen compounds
467 24 21 0 1 0 15 323.178 0.003473 Neutral nitrogen compounds
468 25 21 0 1 0 16 335.178 0.001946 Neutral nitrogen compounds
469 18 22 0 2 0 9 266.196 0.001316 Neutral nitrogen compounds
470 19 22 0 2 0 10 278.196 0.000932 Neutral nitrogen compounds
471 21 22 0 2 0 12 302.196 0.000906 Neutral nitrogen compounds
472 17 23 1 1 0 7 257.194 0.001672 Neutral nitrogen compounds
473 18 23 1 1 0 8 269.194 0.001434 Neutral nitrogen compounds
474 19 23 1 1 0 9 281.194 0.001766 Neutral nitrogen compounds
475 20 23 1 1 0 10 293.194 0.002795 Neutral nitrogen compounds
476 21 23 1 1 0 11 305.194 0.000772 Neutral nitrogen compounds
477 22 23 1 1 0 12 317.194 0.000956 Neutral nitrogen compounds
478 16 23 0 1 0 6 229.194 0.004701 Neutral nitrogen compounds
479 17 23 0 1 0 7 241.194 0.030379 Neutral nitrogen compounds
480 18 23 0 1 0 8 253.194 0.030922 Neutral nitrogen compounds
481 19 23 0 1 0 9 265.194 0.133544 Neutral nitrogen compounds
482 20 23 0 1 0 10 277.194 0.073269 Neutral nitrogen compounds
483 21 23 0 1 0 11 289.194 0.014011 Neutral nitrogen compounds
484 22 23 0 1 0 12 301.194 0.013826 Neutral nitrogen compounds
485 23 23 0 1 0 13 313.194 0.009523 Neutral nitrogen compounds
486 24 23 0 1 0 14 325.194 0.002591 Neutral nitrogen compounds
487 25 23 0 1 0 15 337.194 0.002203 Neutral nitrogen compounds
488 26 23 0 1 0 16 349.194 0.001411 Neutral nitrogen compounds
489 19 24 0 2 0 9 280.212 0.001705 Neutral nitrogen compounds
490 20 24 0 2 0 10 292.212 0.00164 Neutral nitrogen compounds
491 22 24 0 2 0 12 316.212 0.000772 Neutral nitrogen compounds
492 18 25 1 1 0 7 271.21 0.001635 Neutral nitrogen compounds
493 19 25 1 1 0 8 283.21 0.002241 Neutral nitrogen compounds
494 20 25 1 1 0 9 295.21 0.001588 Neutral nitrogen compounds
495 21 25 1 1 0 10 307.21 0.001926 Neutral nitrogen compounds
496 17 25 0 1 0 6 243.21 0.008609 Neutral nitrogen compounds
497 18 25 0 1 0 7 255.21 0.051365 Neutral nitrogen compounds
498 19 25 0 1 0 8 267.21 0.039925 Neutral nitrogen compounds
499 20 25 0 1 0 9 279.21 0.150531 Neutral nitrogen compounds
500 21 25 0 1 0 10 291.21 0.077325 Neutral nitrogen compounds
501 22 25 0 1 0 11 303.21 0.015536 Neutral nitrogen compounds
502 23 25 0 1 0 12 315.21 0.00715 Neutral nitrogen compounds
503 24 25 0 1 0 13 327.21 0.008837 Neutral nitrogen compounds
504 25 25 0 1 0 14 339.21 0.003023 Neutral nitrogen compounds
505 26 25 0 1 0 15 351.21 0.001442 Neutral nitrogen compounds
506 27 25 0 1 0 16 363.21 0.001155 Neutral nitrogen compounds
507 20 26 0 2 0 9 294.228 0.001442 Neutral nitrogen compounds
508 21 26 0 2 0 10 306.228 0.001012 Neutral nitrogen compounds
509 23 26 0 2 0 12 330.228 0.000841 Neutral nitrogen compounds
510 19 27 1 1 0 7 285.226 0.002769 Neutral nitrogen compounds
511 20 27 1 1 0 8 297.226 0.00212 Neutral nitrogen compounds
512 21 27 1 1 0 9 309.226 0.001214 Neutral nitrogen compounds
513 22 27 1 1 0 10 321.226 0.002207 Neutral nitrogen compounds
514 16 27 2 1 0 4 265.226 0.000648 Neutral nitrogen compounds
515 18 27 0 1 0 6 257.226 0.009316 Neutral nitrogen compounds
516 19 27 0 1 0 7 269.226 0.068167 Neutral nitrogen compounds
517 20 27 0 1 0 8 281.226 0.056465 Neutral nitrogen compounds
518 21 27 0 1 0 9 293.226 0.123859 Neutral nitrogen compounds
519 22 27 0 1 0 10 305.226 0.051578 Neutral nitrogen compounds
520 23 27 0 1 0 11 317.226 0.009911 Neutral nitrogen compounds
521 24 27 0 1 0 12 329.226 0.006798 Neutral nitrogen compounds
522 25 27 0 1 0 13 341.226 0.005714 Neutral nitrogen compounds
523 26 27 0 1 0 14 353.226 0.002071 Neutral nitrogen compounds
524 27 27 0 1 0 15 365.226 0.000848 Neutral nitrogen compounds
525 22 28 0 2 0 10 320.244 0.000903 Neutral nitrogen compounds
526 17 29 1 1 0 4 263.242 0.00057 Neutral nitrogen compounds
527 18 29 1 1 0 5 275.242 0.000705 Neutral nitrogen compounds
528 19 29 1 1 0 6 287.242 0.001244 Neutral nitrogen compounds
529 20 29 1 1 0 7 299.242 0.002885 Neutral nitrogen compounds
530 21 29 1 1 0 8 311.242 0.001888 Neutral nitrogen compounds
531 22 29 1 1 0 9 323.242 0.001691 Neutral nitrogen compounds
532 23 29 1 1 0 10 335.242 0.001691 Neutral nitrogen compounds
533 16 29 2 1 0 3 267.242 0.000689 Neutral nitrogen compounds
534 17 29 2 1 0 4 279.242 0.000676 Neutral nitrogen compounds
535 19 29 0 1 0 6 271.242 0.013126 Neutral nitrogen compounds
536 20 29 0 1 0 7 283.242 0.097285 Neutral nitrogen compounds
537 21 29 0 1 0 8 295.242 0.051395 Neutral nitrogen compounds
538 22 29 0 1 0 9 307.242 0.069028 Neutral nitrogen compounds
539 23 29 0 1 0 10 319.242 0.029861 Neutral nitrogen compounds
540 24 29 0 1 0 11 331.242 0.009176 Neutral nitrogen compounds
541 25 29 0 1 0 12 343.242 0.005967 Neutral nitrogen compounds
542 26 29 0 1 0 13 355.242 0.004744 Neutral nitrogen compounds
543 27 29 0 1 0 14 367.242 0.002446 Neutral nitrogen compounds
544 18 31 1 1 0 4 277.258 0.000823 Neutral nitrogen compounds
545 19 31 1 1 0 5 289.258 0.000677 Neutral nitrogen compounds
546 20 31 1 1 0 6 301.258 0.00139 Neutral nitrogen compounds
547 21 31 1 1 0 7 313.258 0.001649 Neutral nitrogen compounds
548 22 31 1 1 0 8 325.258 0.001541 Neutral nitrogen compounds
549 23 31 1 1 0 9 337.258 0.001445 Neutral nitrogen compounds
550 24 31 1 1 0 10 349.258 0.000902 Neutral nitrogen compounds
551 16 31 2 1 0 2 269.258 0.00055 Neutral nitrogen compounds
552 17 31 2 1 0 3 281.258 0.00133 Neutral nitrogen compounds
553 18 31 2 1 0 4 293.258 0.000644 Neutral nitrogen compounds
554 20 31 0 1 0 6 285.258 0.017568 Neutral nitrogen compounds
555 21 31 0 1 0 7 297.258 0.080317 Neutral nitrogen compounds
556 22 31 0 1 0 8 309.258 0.033295 Neutral nitrogen compounds
557 23 31 0 1 0 9 321.258 0.039457 Neutral nitrogen compounds
558 24 31 0 1 0 10 333.258 0.021368 Neutral nitrogen compounds
559 25 31 0 1 0 11 345.258 0.007471 Neutral nitrogen compounds
560 26 31 0 1 0 12 357.258 0.004575 Neutral nitrogen compounds
561 27 31 0 1 0 13 369.258 0.002684 Neutral nitrogen compounds
562 28 31 0 1 0 14 381.258 0.001733 Neutral nitrogen compounds
563 21 32 0 2 0 7 312.276 0.000906 Neutral nitrogen compounds
564 19 33 1 1 0 4 291.274 0.001154 Neutral nitrogen compounds
565 20 33 1 1 0 5 303.274 0.001136 Neutral nitrogen compounds
566 21 33 1 1 0 6 315.274 0.001608 Neutral nitrogen compounds
567 22 33 1 1 0 7 327.274 0.001552 Neutral nitrogen compounds
568 23 33 1 1 0 8 339.274 0.001703 Neutral nitrogen compounds
569 24 33 1 1 0 9 351.274 0.001189 Neutral nitrogen compounds
570 25 33 1 1 0 10 363.274 0.001158 Neutral nitrogen compounds
571 17 33 2 1 0 2 283.274 0.000773 Neutral nitrogen compounds
572 18 33 2 1 0 3 295.274 0.001594 Neutral nitrogen compounds
573 19 33 2 1 0 4 307.274 0.000882 Neutral nitrogen compounds
574 21 33 0 1 0 6 299.274 0.018647 Neutral nitrogen compounds
575 22 33 0 1 0 7 311.274 0.044328 Neutral nitrogen compounds
576 23 33 0 1 0 8 323.274 0.024609 Neutral nitrogen compounds
577 24 33 0 1 0 9 335.274 0.023292 Neutral nitrogen compounds
578 25 33 0 1 0 10 347.274 0.012634 Neutral nitrogen compounds
579 26 33 0 1 0 11 359.274 0.004173 Neutral nitrogen compounds
580 27 33 0 1 0 12 371.274 0.003342 Neutral nitrogen compounds
581 28 33 0 1 0 13 383.274 0.002331 Neutral nitrogen compounds
582 29 33 0 1 0 14 395.274 0.001331 Neutral nitrogen compounds
583 21 34 0 2 0 6 314.292 0.001023 Neutral nitrogen compounds
584 22 34 0 2 0 7 326.292 0.001063 Neutral nitrogen compounds
585 20 35 1 1 0 4 305.29 0.000956 Neutral nitrogen compounds
586 21 35 1 1 0 5 317.29 0.001243 Neutral nitrogen compounds
587 22 35 1 1 0 6 329.29 0.00207 Neutral nitrogen compounds
588 23 35 1 1 0 7 341.29 0.001315 Neutral nitrogen compounds
589 18 35 2 1 0 2 297.29 0.001114 Neutral nitrogen compounds
590 19 35 2 1 0 3 309.29 0.000888 Neutral nitrogen compounds
591 22 35 0 1 0 6 313.29 0.01271 Neutral nitrogen compounds
592 23 35 0 1 0 7 325.29 0.028871 Neutral nitrogen compounds
593 24 35 0 1 0 8 337.29 0.015842 Neutral nitrogen compounds
594 25 35 0 1 0 9 349.29 0.014522 Neutral nitrogen compounds
595 26 35 0 1 0 10 361.29 0.007808 Neutral nitrogen compounds
596 27 35 0 1 0 11 373.29 0.004204 Neutral nitrogen compounds
597 28 35 0 1 0 12 385.29 0.002777 Neutral nitrogen compounds
598 29 35 0 1 0 13 397.29 0.001367 Neutral nitrogen compounds
599 22 36 0 2 0 6 328.308 0.000764 Neutral nitrogen compounds
600 23 36 0 2 0 7 340.308 0.001018 Neutral nitrogen compounds
601 21 37 1 1 0 4 319.306 0.000837 Neutral nitrogen compounds
602 22 37 1 1 0 5 331.306 0.001011 Neutral nitrogen compounds
603 23 37 1 1 0 6 343.306 0.001489 Neutral nitrogen compounds
604 24 37 1 1 0 7 355.306 0.001108 Neutral nitrogen compounds
605 19 37 2 1 0 2 311.306 0.001042 Neutral nitrogen compounds
606 23 37 0 1 0 6 327.306 0.010901 Neutral nitrogen compounds
607 24 37 0 1 0 7 339.306 0.017063 Neutral nitrogen compounds
608 25 37 0 1 0 8 351.306 0.009835 Neutral nitrogen compounds
609 26 37 0 1 0 9 363.306 0.008721 Neutral nitrogen compounds
610 27 37 0 1 0 10 375.306 0.005167 Neutral nitrogen compounds
611 28 37 0 1 0 11 387.306 0.00299 Neutral nitrogen compounds
612 29 37 0 1 0 12 399.306 0.002216 Neutral nitrogen compounds
613 30 37 0 1 0 13 411.306 0.000972 Neutral nitrogen compounds
614 23 38 0 2 0 6 342.324 0.000777 Neutral nitrogen compounds
615 22 39 1 1 0 4 333.322 0.000729 Neutral nitrogen compounds
616 25 39 1 1 0 7 369.322 0.000942 Neutral nitrogen compounds
617 24 39 0 1 0 6 341.322 0.00756 Neutral nitrogen compounds
618 25 39 0 1 0 7 353.322 0.011801 Neutral nitrogen compounds
619 26 39 0 1 0 8 365.322 0.004484 Neutral nitrogen compounds
620 27 39 0 1 0 9 377.322 0.005502 Neutral nitrogen compounds
621 28 39 0 1 0 10 389.322 0.002941 Neutral nitrogen compounds
622 29 39 0 1 0 11 401.322 0.002112 Neutral nitrogen compounds
623 30 39 0 1 0 12 413.322 0.001126 Neutral nitrogen compounds
624 26 41 1 1 0 7 383.338 0.00107 Neutral nitrogen compounds
625 25 41 0 1 0 6 355.338 0.004065 Neutral nitrogen compounds
626 26 41 0 1 0 7 367.338 0.004982 Neutral nitrogen compounds
627 27 41 0 1 0 8 379.338 0.002783 Neutral nitrogen compounds
628 28 41 0 1 0 9 391.338 0.003536 Neutral nitrogen compounds
629 29 41 0 1 0 10 403.338 0.002788 Neutral nitrogen compounds
630 31 41 0 1 0 12 427.338 0.0016 Neutral nitrogen compounds
631 26 43 0 1 0 6 369.354 0.002936 Neutral nitrogen compounds
632 27 43 0 1 0 7 381.354 0.002247 Neutral nitrogen compounds
633 28 43 0 1 0 8 393.354 0.001773 Neutral nitrogen compounds
634 29 43 0 1 0 9 405.354 0.00227 Neutral nitrogen compounds
635 30 43 0 1 0 10 417.354 0.001496 Neutral nitrogen compounds
636 27 45 0 1 0 6 383.37 0.00173 Neutral nitrogen compounds
637 28 45 0 1 0 7 395.37 0.002408 Neutral nitrogen compounds
638 29 45 0 1 0 8 407.37 0.001576 Neutral nitrogen compounds
639 30 45 0 1 0 9 419.37 0.001914 Neutral nitrogen compounds
640 31 45 0 1 0 10 431.37 0.001015 Neutral nitrogen compounds
641 28 47 0 1 0 6 397.386 0.001303 Neutral nitrogen compounds
642 30 47 0 1 0 8 421.386 0.001059 Neutral nitrogen compounds
643 31 47 0 1 0 9 433.386 0.001375 Neutral nitrogen compounds
644 32 47 0 1 0 10 445.386 0.000998 Neutral nitrogen compounds
645 29 49 0 1 0 6 411.402 0.001409 Neutral nitrogen compounds
646 30 49 0 1 0 7 423.402 0.001063 Neutral nitrogen compounds
647 32 55 0 1 0 6 453.45 0.001078 Neutral nitrogen compounds
648 39 69 0 1 0 6 551.562 0.001947 Neutral nitrogen compounds
649 37 10 0 0 1 33 486.14 0.00015 Sulfidic compounds
650 13 12 0 0 1 8 200.156 0.000122 Sulfidic compounds
651 14 12 0 0 1 9 212.156 0.000249 Sulfidic compounds
652 15 12 0 0 1 10 224.156 0.000194 Sulfidic compounds
653 16 12 0 0 1 11 236.156 1.9e-05 Sulfidic compounds
654 17 12 0 0 1 12 248.156 9.1e-05 Sulfidic compounds
655 18 12 0 0 1 13 260.156 1.3e-05 Sulfidic compounds
656 19 12 0 0 1 14 272.156 2.9e-05 Sulfidic compounds
657 27 12 0 0 1 22 368.156 1.1e-05 Sulfidic compounds
658 33 12 0 0 1 28 440.156 6e-05 Sulfidic compounds
659 34 12 0 0 1 29 452.156 0.000356 Sulfidic compounds
660 13 14 0 0 1 7 202.172 8.9e-05 Sulfidic compounds
661 14 14 0 0 1 8 214.172 4.4e-05 Sulfidic compounds
662 15 14 0 0 1 9 226.172 0.000667 Sulfidic compounds
663 16 14 0 0 1 10 238.172 0.000144 Sulfidic compounds
664 17 14 0 0 1 11 250.172 9.5e-05 Sulfidic compounds
665 18 14 0 0 1 12 262.172 2.1e-05 Sulfidic compounds
666 19 14 0 0 1 13 274.172 0.000299 Sulfidic compounds
667 23 14 0 0 1 17 322.172 9e-06 Sulfidic compounds
668 35 14 0 0 1 29 466.172 1e-05 Sulfidic compounds
669 45 14 0 0 1 39 586.172 1.5e-05 Sulfidic compounds
670 52 14 0 0 1 46 670.172 7e-05 Sulfidic compounds
671 14 16 0 0 1 7 216.188 8.1e-05 Sulfidic compounds
672 15 16 0 0 1 8 228.188 7.9e-05 Sulfidic compounds
673 16 16 0 0 1 9 240.188 0.00095 Sulfidic compounds
674 17 16 0 0 1 10 252.188 0.00025 Sulfidic compounds
675 18 16 0 0 1 11 264.188 0.000126 Sulfidic compounds
676 19 16 0 0 1 12 276.188 0.000249 Sulfidic compounds
677 20 16 0 0 1 13 288.188 0.000199 Sulfidic compounds
678 22 16 0 0 1 15 312.188 7e-06 Sulfidic compounds
679 30 16 0 0 1 23 408.188 0.000284 Sulfidic compounds
680 38 16 0 0 1 31 504.188 1.1e-05 Sulfidic compounds
681 46 16 0 0 1 39 600.188 1.9e-05 Sulfidic compounds
682 13 18 0 0 1 5 206.204 9e-06 Sulfidic compounds
683 14 18 0 0 1 6 218.204 0.000467 Sulfidic compounds
684 15 18 0 0 1 7 230.204 0.000465 Sulfidic compounds
685 16 18 0 0 1 8 242.204 0.000193 Sulfidic compounds
686 17 18 0 0 1 9 254.204 0.000935 Sulfidic compounds
687 18 18 0 0 1 10 266.204 0.000209 Sulfidic compounds
688 19 18 0 0 1 11 278.204 0.000342 Sulfidic compounds
689 20 18 0 0 1 12 290.204 0.000681 Sulfidic compounds
690 21 18 0 0 1 13 302.204 3e-05 Sulfidic compounds
691 23 18 0 0 1 15 326.204 7e-06 Sulfidic compounds
692 25 18 0 0 1 17 350.204 0.000343 Sulfidic compounds
693 40 18 0 0 1 32 530.204 1.3e-05 Sulfidic compounds
694 13 20 0 0 1 4 208.22 5.8e-05 Sulfidic compounds
695 14 20 0 0 1 5 220.22 0.00036 Sulfidic compounds
696 15 20 0 0 1 6 232.22 0.002456 Sulfidic compounds
697 16 20 0 0 1 7 244.22 0.001976 Sulfidic compounds
698 17 20 0 0 1 8 256.22 0.00045 Sulfidic compounds
699 18 20 0 0 1 9 268.22 0.000926 Sulfidic compounds
700 19 20 0 0 1 10 280.22 0.001421 Sulfidic compounds
701 20 20 0 0 1 11 292.22 0.000256 Sulfidic compounds
702 21 20 0 0 1 12 304.22 3.3e-05 Sulfidic compounds
703 22 20 0 0 1 13 316.22 9e-06 Sulfidic compounds
704 24 20 0 0 1 15 340.22 1.7e-05 Sulfidic compounds
705 45 20 0 0 1 36 592.22 1.5e-05 Sulfidic compounds
706 13 22 0 0 1 3 210.236 0.000385 Sulfidic compounds
707 14 22 0 0 1 4 222.236 0.0009 Sulfidic compounds
708 15 22 0 0 1 5 234.236 0.00172 Sulfidic compounds
709 16 22 0 0 1 6 246.236 0.007706 Sulfidic compounds
710 17 22 0 0 1 7 258.236 0.00493 Sulfidic compounds
711 18 22 0 0 1 8 270.236 0.001602 Sulfidic compounds
712 19 22 0 0 1 9 282.236 0.001755 Sulfidic compounds
713 20 22 0 0 1 10 294.236 0.000261 Sulfidic compounds
714 21 22 0 0 1 11 306.236 6.1e-05 Sulfidic compounds
715 22 22 0 0 1 12 318.236 4.9e-05 Sulfidic compounds
716 23 22 0 0 1 13 330.236 9e-06 Sulfidic compounds
717 26 22 0 0 1 16 366.236 1.1e-05 Sulfidic compounds
718 28 22 0 0 1 18 390.236 1.1e-05 Sulfidic compounds
719 29 22 0 0 1 19 402.236 1.8e-05 Sulfidic compounds
720 39 22 0 0 1 29 522.236 0.000242 Sulfidic compounds
721 13 24 0 0 1 2 212.252 0.00044 Sulfidic compounds
722 14 24 0 0 1 3 224.252 0.002908 Sulfidic compounds
723 15 24 0 0 1 4 236.252 0.00435 Sulfidic compounds
724 16 24 0 0 1 5 248.252 0.005136 Sulfidic compounds
725 17 24 0 0 1 6 260.252 0.012781 Sulfidic compounds
726 18 24 0 0 1 7 272.252 0.008198 Sulfidic compounds
727 19 24 0 0 1 8 284.252 0.002381 Sulfidic compounds
728 20 24 0 0 1 9 296.252 0.000466 Sulfidic compounds
729 21 24 0 0 1 10 308.252 0.000257 Sulfidic compounds
730 22 24 0 0 1 11 320.252 6.5e-05 Sulfidic compounds
731 23 24 0 0 1 12 332.252 1e-05 Sulfidic compounds
732 27 24 0 0 1 16 380.252 9e-06 Sulfidic compounds
733 29 24 0 0 1 18 404.252 0.000274 Sulfidic compounds
734 35 24 0 0 1 24 476.252 7.6e-05 Sulfidic compounds
735 50 24 0 0 1 39 656.252 1.5e-05 Sulfidic compounds
736 13 26 0 0 1 1 214.268 4.9e-05 Sulfidic compounds
737 14 26 0 0 1 2 226.268 0.00175 Sulfidic compounds
738 15 26 0 0 1 3 238.268 0.009693 Sulfidic compounds
739 16 26 0 0 1 4 250.268 0.011275 Sulfidic compounds
740 17 26 0 0 1 5 262.268 0.011277 Sulfidic compounds
741 18 26 0 0 1 6 274.268 0.020157 Sulfidic compounds
742 19 26 0 0 1 7 286.268 0.01082 Sulfidic compounds
743 20 26 0 0 1 8 298.268 0.00303 Sulfidic compounds
744 21 26 0 0 1 9 310.268 0.000574 Sulfidic compounds
745 22 26 0 0 1 10 322.268 0.000288 Sulfidic compounds
746 23 26 0 0 1 11 334.268 9.8e-05 Sulfidic compounds
747 24 26 0 0 1 12 346.268 4.6e-05 Sulfidic compounds
748 25 26 0 0 1 13 358.268 9e-06 Sulfidic compounds
749 26 26 0 0 1 14 370.268 0.000225 Sulfidic compounds
750 31 26 0 0 1 19 430.268 1.1e-05 Sulfidic compounds
751 33 26 0 0 1 21 454.268 1.6e-05 Sulfidic compounds
752 14 28 0 0 1 1 228.284 0.000211 Sulfidic compounds
753 15 28 0 0 1 2 240.284 0.004368 Sulfidic compounds
754 16 28 0 0 1 3 252.284 0.022255 Sulfidic compounds
755 17 28 0 0 1 4 264.284 0.020124 Sulfidic compounds
756 18 28 0 0 1 5 276.284 0.020716 Sulfidic compounds
757 19 28 0 0 1 6 288.284 0.021536 Sulfidic compounds
758 20 28 0 0 1 7 300.284 0.012216 Sulfidic compounds
759 21 28 0 0 1 8 312.284 0.00267 Sulfidic compounds
760 22 28 0 0 1 9 324.284 0.000567 Sulfidic compounds
761 23 28 0 0 1 10 336.284 0.000261 Sulfidic compounds
762 24 28 0 0 1 11 348.284 3.5e-05 Sulfidic compounds
763 25 28 0 0 1 12 360.284 2.9e-05 Sulfidic compounds
764 26 28 0 0 1 13 372.284 6.8e-05 Sulfidic compounds
765 31 28 0 0 1 18 432.284 1.1e-05 Sulfidic compounds
766 14 30 0 0 1 0 230.3 1.4e-05 Sulfidic compounds
767 15 30 0 0 1 1 242.3 0.000554 Sulfidic compounds
768 16 30 0 0 1 2 254.3 0.007191 Sulfidic compounds
769 17 30 0 0 1 3 266.3 0.022925 Sulfidic compounds
770 18 30 0 0 1 4 278.3 0.03366 Sulfidic compounds
771 19 30 0 0 1 5 290.3 0.024058 Sulfidic compounds
772 20 30 0 0 1 6 302.3 0.018871 Sulfidic compounds
773 21 30 0 0 1 7 314.3 0.009298 Sulfidic compounds
774 22 30 0 0 1 8 326.3 0.002345 Sulfidic compounds
775 23 30 0 0 1 9 338.3 0.000617 Sulfidic compounds
776 24 30 0 0 1 10 350.3 0.000223 Sulfidic compounds
777 25 30 0 0 1 11 362.3 5.5e-05 Sulfidic compounds
778 26 30 0 0 1 12 374.3 9e-06 Sulfidic compounds
779 30 30 0 0 1 16 422.3 9e-06 Sulfidic compounds
780 37 30 0 0 1 23 506.3 1.2e-05 Sulfidic compounds
781 50 30 0 0 1 36 662.3 1.7e-05 Sulfidic compounds
782 16 32 0 0 1 1 256.316 0.000937 Sulfidic compounds
783 17 32 0 0 1 2 268.316 0.009553 Sulfidic compounds
784 18 32 0 0 1 3 280.316 0.038688 Sulfidic compounds
785 19 32 0 0 1 4 292.316 0.036216 Sulfidic compounds
786 20 32 0 0 1 5 304.316 0.024618 Sulfidic compounds
787 21 32 0 0 1 6 316.316 0.013896 Sulfidic compounds
788 22 32 0 0 1 7 328.316 0.006661 Sulfidic compounds
789 23 32 0 0 1 8 340.316 0.001923 Sulfidic compounds
790 24 32 0 0 1 9 352.316 0.00065 Sulfidic compounds
791 25 32 0 0 1 10 364.316 0.000194 Sulfidic compounds
792 26 32 0 0 1 11 376.316 5.4e-05 Sulfidic compounds
793 27 32 0 0 1 12 388.316 1.6e-05 Sulfidic compounds
794 29 32 0 0 1 14 412.316 1.5e-05 Sulfidic compounds
795 31 32 0 0 1 16 436.316 2.2e-05 Sulfidic compounds
796 16 34 0 0 1 0 258.332 1.7e-05 Sulfidic compounds
797 17 34 0 0 1 1 270.332 0.001298 Sulfidic compounds
798 18 34 0 0 1 2 282.332 0.014232 Sulfidic compounds
799 19 34 0 0 1 3 294.332 0.037019 Sulfidic compounds
800 20 34 0 0 1 4 306.332 0.033466 Sulfidic compounds
801 21 34 0 0 1 5 318.332 0.017586 Sulfidic compounds
802 22 34 0 0 1 6 330.332 0.009782 Sulfidic compounds
803 23 34 0 0 1 7 342.332 0.003959 Sulfidic compounds
804 24 34 0 0 1 8 354.332 0.001525 Sulfidic compounds
805 25 34 0 0 1 9 366.332 0.000614 Sulfidic compounds
806 26 34 0 0 1 10 378.332 0.000255 Sulfidic compounds
807 27 34 0 0 1 11 390.332 5.6e-05 Sulfidic compounds
808 28 34 0 0 1 12 402.332 1.6e-05 Sulfidic compounds
809 43 34 0 0 1 27 582.332 1.4e-05 Sulfidic compounds
810 18 36 0 0 1 1 284.348 0.001985 Sulfidic compounds
811 19 36 0 0 1 2 296.348 0.012274 Sulfidic compounds
812 20 36 0 0 1 3 308.348 0.030021 Sulfidic compounds
813 21 36 0 0 1 4 320.348 0.023163 Sulfidic compounds
814 22 36 0 0 1 5 332.348 0.011901 Sulfidic compounds
815 23 36 0 0 1 6 344.348 0.005648 Sulfidic compounds
816 24 36 0 0 1 7 356.348 0.002793 Sulfidic compounds
817 25 36 0 0 1 8 368.348 0.001278 Sulfidic compounds
818 26 36 0 0 1 9 380.348 0.000653 Sulfidic compounds
819 27 36 0 0 1 10 392.348 0.000197 Sulfidic compounds
820 28 36 0 0 1 11 404.348 6.6e-05 Sulfidic compounds
821 29 36 0 0 1 12 416.348 1.5e-05 Sulfidic compounds
822 33 36 0 0 1 16 464.348 0.000229 Sulfidic compounds
823 46 36 0 0 1 29 620.348 1.6e-05 Sulfidic compounds
824 18 38 0 0 1 0 286.364 6e-06 Sulfidic compounds
825 19 38 0 0 1 1 298.364 0.001903 Sulfidic compounds
826 20 38 0 0 1 2 310.364 0.011926 Sulfidic compounds
827 21 38 0 0 1 3 322.364 0.02098 Sulfidic compounds
828 22 38 0 0 1 4 334.364 0.014393 Sulfidic compounds
829 23 38 0 0 1 5 346.364 0.006597 Sulfidic compounds
830 24 38 0 0 1 6 358.364 0.003479 Sulfidic compounds
831 25 38 0 0 1 7 370.364 0.001724 Sulfidic compounds
832 26 38 0 0 1 8 382.364 0.001029 Sulfidic compounds
833 27 38 0 0 1 9 394.364 0.000637 Sulfidic compounds
834 28 38 0 0 1 10 406.364 0.00016 Sulfidic compounds
835 29 38 0 0 1 11 418.364 3.1e-05 Sulfidic compounds
836 30 38 0 0 1 12 430.364 9e-06 Sulfidic compounds
837 34 38 0 0 1 16 478.364 5.5e-05 Sulfidic compounds
838 20 40 0 0 1 1 312.38 0.001986 Sulfidic compounds
839 21 40 0 0 1 2 324.38 0.008787 Sulfidic compounds
840 22 40 0 0 1 3 336.38 0.013027 Sulfidic compounds
841 23 40 0 0 1 4 348.38 0.007659 Sulfidic compounds
842 24 40 0 0 1 5 360.38 0.003898 Sulfidic compounds
843 25 40 0 0 1 6 372.38 0.001857 Sulfidic compounds
844 26 40 0 0 1 7 384.38 0.001113 Sulfidic compounds
845 27 40 0 0 1 8 396.38 0.000831 Sulfidic compounds
846 28 40 0 0 1 9 408.38 0.000603 Sulfidic compounds
847 29 40 0 0 1 10 420.38 0.000215 Sulfidic compounds
848 30 40 0 0 1 11 432.38 1.9e-05 Sulfidic compounds
849 31 40 0 0 1 12 444.38 1e-05 Sulfidic compounds
850 35 40 0 0 1 16 492.38 0.000172 Sulfidic compounds
851 21 42 0 0 1 1 326.396 0.001784 Sulfidic compounds
852 22 42 0 0 1 2 338.396 0.00566 Sulfidic compounds
853 23 42 0 0 1 3 350.396 0.00679 Sulfidic compounds
854 24 42 0 0 1 4 362.396 0.004762 Sulfidic compounds
855 25 42 0 0 1 5 374.396 0.00221 Sulfidic compounds
856 26 42 0 0 1 6 386.396 0.00108 Sulfidic compounds
857 27 42 0 0 1 7 398.396 0.000683 Sulfidic compounds
858 28 42 0 0 1 8 410.396 0.000446 Sulfidic compounds
859 29 42 0 0 1 9 422.396 0.000508 Sulfidic compounds
860 30 42 0 0 1 10 434.396 0.000133 Sulfidic compounds
861 31 42 0 0 1 11 446.396 3.8e-05 Sulfidic compounds
862 32 42 0 0 1 12 458.396 2.3e-05 Sulfidic compounds
863 36 42 0 0 1 16 506.396 9.6e-05 Sulfidic compounds
864 21 44 0 0 1 0 328.412 7e-06 Sulfidic compounds
865 22 44 0 0 1 1 340.412 0.001435 Sulfidic compounds
866 23 44 0 0 1 2 352.412 0.003859 Sulfidic compounds
867 24 44 0 0 1 3 364.412 0.004233 Sulfidic compounds
868 25 44 0 0 1 4 376.412 0.002203 Sulfidic compounds
869 26 44 0 0 1 5 388.412 0.001142 Sulfidic compounds
870 27 44 0 0 1 6 400.412 0.000666 Sulfidic compounds
871 28 44 0 0 1 7 412.412 0.00044 Sulfidic compounds
872 29 44 0 0 1 8 424.412 0.00045 Sulfidic compounds
873 30 44 0 0 1 9 436.412 0.00037 Sulfidic compounds
874 31 44 0 0 1 10 448.412 8.8e-05 Sulfidic compounds
875 33 44 0 0 1 12 472.412 1.4e-05 Sulfidic compounds
876 37 44 0 0 1 16 520.412 0.000163 Sulfidic compounds
877 38 44 0 0 1 17 532.412 1.4e-05 Sulfidic compounds
878 22 46 0 0 1 0 342.428 5.5e-05 Sulfidic compounds
879 23 46 0 0 1 1 354.428 0.001164 Sulfidic compounds
880 24 46 0 0 1 2 366.428 0.002602 Sulfidic compounds
881 25 46 0 0 1 3 378.428 0.002214 Sulfidic compounds
882 26 46 0 0 1 4 390.428 0.001197 Sulfidic compounds
883 27 46 0 0 1 5 402.428 0.000725 Sulfidic compounds
884 28 46 0 0 1 6 414.428 0.000385 Sulfidic compounds
885 29 46 0 0 1 7 426.428 0.000252 Sulfidic compounds
886 30 46 0 0 1 8 438.428 0.000245 Sulfidic compounds
887 31 46 0 0 1 9 450.428 0.000188 Sulfidic compounds
888 32 46 0 0 1 10 462.428 0.000164 Sulfidic compounds
889 33 46 0 0 1 11 474.428 4.5e-05 Sulfidic compounds
890 34 46 0 0 1 12 486.428 1.7e-05 Sulfidic compounds
891 35 46 0 0 1 13 498.428 1.1e-05 Sulfidic compounds
892 38 46 0 0 1 16 534.428 5.3e-05 Sulfidic compounds
893 43 46 0 0 1 21 594.428 2e-05 Sulfidic compounds
894 44 46 0 0 1 22 606.428 1.3e-05 Sulfidic compounds
895 49 46 0 0 1 27 666.428 1.4e-05 Sulfidic compounds
896 23 48 0 0 1 0 356.444 2.4e-05 Sulfidic compounds
897 24 48 0 0 1 1 368.444 0.000746 Sulfidic compounds
898 25 48 0 0 1 2 380.444 0.001531 Sulfidic compounds
899 26 48 0 0 1 3 392.444 0.001119 Sulfidic compounds
900 27 48 0 0 1 4 404.444 0.000717 Sulfidic compounds
901 28 48 0 0 1 5 416.444 0.000411 Sulfidic compounds
902 29 48 0 0 1 6 428.444 0.000287 Sulfidic compounds
903 30 48 0 0 1 7 440.444 0.000244 Sulfidic compounds
904 31 48 0 0 1 8 452.444 8.9e-05 Sulfidic compounds
905 32 48 0 0 1 9 464.444 0.00011 Sulfidic compounds
906 33 48 0 0 1 10 476.444 6e-05 Sulfidic compounds
907 34 48 0 0 1 11 488.444 1.1e-05 Sulfidic compounds
908 39 48 0 0 1 16 548.444 3.5e-05 Sulfidic compounds
909 24 50 0 0 1 0 370.46 9e-06 Sulfidic compounds
910 25 50 0 0 1 1 382.46 0.000423 Sulfidic compounds
911 26 50 0 0 1 2 394.46 0.000788 Sulfidic compounds
912 27 50 0 0 1 3 406.46 0.00062 Sulfidic compounds
913 28 50 0 0 1 4 418.46 0.0004 Sulfidic compounds
914 29 50 0 0 1 5 430.46 0.000297 Sulfidic compounds
915 30 50 0 0 1 6 442.46 0.000176 Sulfidic compounds
916 31 50 0 0 1 7 454.46 0.000106 Sulfidic compounds
917 32 50 0 0 1 8 466.46 4.5e-05 Sulfidic compounds
918 33 50 0 0 1 9 478.46 7.4e-05 Sulfidic compounds
919 34 50 0 0 1 10 490.46 3e-05 Sulfidic compounds
920 35 50 0 0 1 11 502.46 1.1e-05 Sulfidic compounds
921 40 50 0 0 1 16 562.46 3.4e-05 Sulfidic compounds
922 46 50 0 0 1 22 634.46 1.4e-05 Sulfidic compounds
923 50 50 0 0 1 26 682.46 1.6e-05 Sulfidic compounds
924 26 52 0 0 1 1 396.476 0.000198 Sulfidic compounds
925 27 52 0 0 1 2 408.476 0.000375 Sulfidic compounds
926 28 52 0 0 1 3 420.476 0.000297 Sulfidic compounds
927 29 52 0 0 1 4 432.476 0.000253 Sulfidic compounds
928 30 52 0 0 1 5 444.476 0.000231 Sulfidic compounds
929 31 52 0 0 1 6 456.476 7.5e-05 Sulfidic compounds
930 32 52 0 0 1 7 468.476 0.000118 Sulfidic compounds
931 33 52 0 0 1 8 480.476 3.2e-05 Sulfidic compounds
932 34 52 0 0 1 9 492.476 2.2e-05 Sulfidic compounds
933 35 52 0 0 1 10 504.476 3.6e-05 Sulfidic compounds
934 36 52 0 0 1 11 516.476 1.2e-05 Sulfidic compounds
935 27 54 0 0 1 1 410.492 5.8e-05 Sulfidic compounds
936 28 54 0 0 1 2 422.492 0.000179 Sulfidic compounds
937 29 54 0 0 1 3 434.492 0.000224 Sulfidic compounds
938 30 54 0 0 1 4 446.492 0.000176 Sulfidic compounds
939 31 54 0 0 1 5 458.492 9.8e-05 Sulfidic compounds
940 32 54 0 0 1 6 470.492 1.7e-05 Sulfidic compounds
941 33 54 0 0 1 7 482.492 3e-05 Sulfidic compounds
942 35 54 0 0 1 9 506.492 1.2e-05 Sulfidic compounds
943 37 54 0 0 1 11 530.492 1.9e-05 Sulfidic compounds
944 53 54 0 0 1 27 722.492 2.3e-05 Sulfidic compounds
945 28 56 0 0 1 1 424.508 5.6e-05 Sulfidic compounds
946 29 56 0 0 1 2 436.508 0.00011 Sulfidic compounds
947 30 56 0 0 1 3 448.508 9.8e-05 Sulfidic compounds
948 31 56 0 0 1 4 460.508 0.00013 Sulfidic compounds
949 32 56 0 0 1 5 472.508 1.2e-05 Sulfidic compounds
950 33 56 0 0 1 6 484.508 7.6e-05 Sulfidic compounds
951 34 56 0 0 1 7 496.508 5.3e-05 Sulfidic compounds
952 28 58 0 0 1 0 426.524 1e-05 Sulfidic compounds
953 30 58 0 0 1 2 450.524 8.4e-05 Sulfidic compounds
954 31 58 0 0 1 3 462.524 8.9e-05 Sulfidic compounds
955 32 58 0 0 1 4 474.524 4.1e-05 Sulfidic compounds
956 33 58 0 0 1 5 486.524 0.000113 Sulfidic compounds
957 34 58 0 0 1 6 498.524 3.2e-05 Sulfidic compounds
958 35 58 0 0 1 7 510.524 6.7e-05 Sulfidic compounds
959 36 58 0 0 1 8 522.524 2e-05 Sulfidic compounds
960 37 58 0 0 1 9 534.524 5.3e-05 Sulfidic compounds
961 51 58 0 0 1 23 702.524 1.6e-05 Sulfidic compounds
962 31 60 0 0 1 2 464.54 1.1e-05 Sulfidic compounds
963 32 60 0 0 1 3 476.54 3.6e-05 Sulfidic compounds
964 33 60 0 0 1 4 488.54 3.5e-05 Sulfidic compounds
965 34 60 0 0 1 5 500.54 4.9e-05 Sulfidic compounds
966 35 60 0 0 1 6 512.54 2.8e-05 Sulfidic compounds
967 36 60 0 0 1 7 524.54 3e-05 Sulfidic compounds
968 37 60 0 0 1 8 536.54 1.8e-05 Sulfidic compounds
969 41 60 0 0 1 12 584.54 1.6e-05 Sulfidic compounds
970 32 62 0 0 1 2 478.556 1.3e-05 Sulfidic compounds
971 33 62 0 0 1 3 490.556 2.6e-05 Sulfidic compounds
972 34 62 0 0 1 4 502.556 4.3e-05 Sulfidic compounds
973 35 62 0 0 1 5 514.556 1.3e-05 Sulfidic compounds
974 36 62 0 0 1 6 526.556 1.6e-05 Sulfidic compounds
975 34 64 0 0 1 3 504.572 6.2e-05 Sulfidic compounds
976 35 64 0 0 1 4 516.572 1.3e-05 Sulfidic compounds
977 37 64 0 0 1 6 540.572 1.8e-05 Sulfidic compounds
978 40 64 0 0 1 9 576.572 8.2e-05 Sulfidic compounds
979 34 66 0 0 1 2 506.588 2.1e-05 Sulfidic compounds
980 35 66 0 0 1 3 518.588 1.6e-05 Sulfidic compounds
981 36 66 0 0 1 4 530.588 5.9e-05 Sulfidic compounds
982 39 66 0 0 1 7 566.588 1.2e-05 Sulfidic compounds
983 40 66 0 0 1 8 578.588 3.5e-05 Sulfidic compounds
984 41 66 0 0 1 9 590.588 1.5e-05 Sulfidic compounds
985 38 68 0 0 1 5 556.604 1.3e-05 Sulfidic compounds
986 39 68 0 0 1 6 568.604 3e-05 Sulfidic compounds
987 42 68 0 0 1 9 604.604 0.000133 Sulfidic compounds
988 45 68 0 0 1 12 640.604 1.8e-05 Sulfidic compounds
989 51 68 0 0 1 18 712.604 1.7e-05 Sulfidic compounds
990 53 68 0 0 1 20 736.604 0.000459 Sulfidic compounds
991 44 72 0 0 1 9 632.636 3.2e-05 Sulfidic compounds
992 38 74 0 0 1 2 562.652 1.5e-05 Sulfidic compounds
993 41 74 0 0 1 5 598.652 1.7e-05 Sulfidic compounds
994 43 74 0 0 1 7 622.652 2.1e-05 Sulfidic compounds
995 44 74 0 0 1 8 634.652 1.6e-05 Sulfidic compounds
996 43 76 0 0 1 6 624.668 1.5e-05 Sulfidic compounds
997 53 76 0 0 1 16 744.668 1.9e-05 Sulfidic compounds
998 39 78 0 0 1 1 578.684 1.4e-05 Sulfidic compounds
999 41 78 0 0 1 3 602.684 1.4e-05 Sulfidic compounds
1000 43 78 0 0 1 5 626.684 1.4e-05 Sulfidic compounds
1001 42 80 0 0 1 3 616.7 1.5e-05 Sulfidic compounds
1002 45 80 0 0 1 6 652.7 1.5e-05 Sulfidic compounds
1003 48 80 0 0 1 9 688.7 3.5e-05 Sulfidic compounds
1004 47 82 0 0 1 7 678.716 1.6e-05 Sulfidic compounds
1005 49 88 0 0 1 6 708.764 1.6e-05 Sulfidic compounds
1006 53 102 0 0 1 3 770.876 1.6e-05 Sulfidic compounds
1007 19 12 0 0 1 14 272.156 7.7e-05 Thiophenic compounds
1008 27 12 0 0 1 22 368.156 0.000195 Thiophenic compounds
1009 33 12 0 0 1 28 440.156 7.2e-05 Thiophenic compounds
1010 34 12 0 0 1 29 452.156 0.000168 Thiophenic compounds
1011 35 12 0 0 1 30 464.156 0.000122 Thiophenic compounds
1012 36 12 0 0 1 31 476.156 9.3e-05 Thiophenic compounds
1013 42 12 0 0 1 37 548.156 9e-05 Thiophenic compounds
1014 13 14 0 0 1 7 202.172 0.000308 Thiophenic compounds
1015 14 14 0 0 1 8 214.172 0.000525 Thiophenic compounds
1016 15 14 0 0 1 9 226.172 0.015653 Thiophenic compounds
1017 16 14 0 0 1 10 238.172 0.001596 Thiophenic compounds
1018 17 14 0 0 1 11 250.172 0.000587 Thiophenic compounds
1019 18 14 0 0 1 12 262.172 0.00021 Thiophenic compounds
1020 19 14 0 0 1 13 274.172 0.001993 Thiophenic compounds
1021 22 14 0 0 1 16 310.172 6.2e-05 Thiophenic compounds
1022 23 14 0 0 1 17 322.172 0.000341 Thiophenic compounds
1023 29 14 0 0 1 23 394.172 6.7e-05 Thiophenic compounds
1024 35 14 0 0 1 29 466.172 0.000101 Thiophenic compounds
1025 45 14 0 0 1 39 586.172 0.00029 Thiophenic compounds
1026 14 16 0 0 1 7 216.188 0.000588 Thiophenic compounds
1027 15 16 0 0 1 8 228.188 0.001224 Thiophenic compounds
1028 16 16 0 0 1 9 240.188 0.029956 Thiophenic compounds
1029 17 16 0 0 1 10 252.188 0.003734 Thiophenic compounds
1030 18 16 0 0 1 11 264.188 0.001158 Thiophenic compounds
1031 19 16 0 0 1 12 276.188 0.001812 Thiophenic compounds
1032 20 16 0 0 1 13 288.188 0.002029 Thiophenic compounds
1033 23 16 0 0 1 16 324.188 0.000137 Thiophenic compounds
1034 25 16 0 0 1 18 348.188 5.7e-05 Thiophenic compounds
1035 30 16 0 0 1 23 408.188 0.00233 Thiophenic compounds
1036 14 18 0 0 1 6 218.204 0.002134 Thiophenic compounds
1037 15 18 0 0 1 7 230.204 0.003957 Thiophenic compounds
1038 16 18 0 0 1 8 242.204 0.003852 Thiophenic compounds
1039 17 18 0 0 1 9 254.204 0.043031 Thiophenic compounds
1040 18 18 0 0 1 10 266.204 0.005818 Thiophenic compounds
1041 19 18 0 0 1 11 278.204 0.002847 Thiophenic compounds
1042 20 18 0 0 1 12 290.204 0.007627 Thiophenic compounds
1043 21 18 0 0 1 13 302.204 0.000482 Thiophenic compounds
1044 24 18 0 0 1 16 338.204 0.000174 Thiophenic compounds
1045 25 18 0 0 1 17 350.204 0.003211 Thiophenic compounds
1046 30 18 0 0 1 22 410.204 0.000538 Thiophenic compounds
1047 15 20 0 0 1 6 232.22 0.00755 Thiophenic compounds
1048 16 20 0 0 1 7 244.22 0.01335 Thiophenic compounds
1049 17 20 0 0 1 8 256.22 0.007563 Thiophenic compounds
1050 18 20 0 0 1 9 268.22 0.04083 Thiophenic compounds
1051 19 20 0 0 1 10 280.22 0.018692 Thiophenic compounds
1052 20 20 0 0 1 11 292.22 0.002125 Thiophenic compounds
1053 21 20 0 0 1 12 304.22 0.000311 Thiophenic compounds
1054 22 20 0 0 1 13 316.22 5.2e-05 Thiophenic compounds
1055 24 20 0 0 1 15 340.22 0.000124 Thiophenic compounds
1056 25 20 0 0 1 16 352.22 0.000198 Thiophenic compounds
1057 31 20 0 0 1 22 424.22 0.000172 Thiophenic compounds
1058 14 22 0 0 1 4 222.236 0.000216 Thiophenic compounds
1059 15 22 0 0 1 5 234.236 9.3e-05 Thiophenic compounds
1060 16 22 0 0 1 6 246.236 0.016173 Thiophenic compounds
1061 17 22 0 0 1 7 258.236 0.024684 Thiophenic compounds
1062 18 22 0 0 1 8 270.236 0.01757 Thiophenic compounds
1063 19 22 0 0 1 9 282.236 0.040579 Thiophenic compounds
1064 20 22 0 0 1 10 294.236 0.011046 Thiophenic compounds
1065 21 22 0 0 1 11 306.236 0.000875 Thiophenic compounds
1066 22 22 0 0 1 12 318.236 0.001255 Thiophenic compounds
1067 26 22 0 0 1 16 366.236 0.000405 Thiophenic compounds
1068 39 22 0 0 1 29 522.236 0.00184 Thiophenic compounds
1069 15 24 0 0 1 4 236.252 3.9e-05 Thiophenic compounds
1070 16 24 0 0 1 5 248.252 0.000108 Thiophenic compounds
1071 17 24 0 0 1 6 260.252 0.023667 Thiophenic compounds
1072 18 24 0 0 1 7 272.252 0.031763 Thiophenic compounds
1073 19 24 0 0 1 8 284.252 0.018613 Thiophenic compounds
1074 20 24 0 0 1 9 296.252 0.02129 Thiophenic compounds
1075 21 24 0 0 1 10 308.252 0.012856 Thiophenic compounds
1076 22 24 0 0 1 11 320.252 0.001359 Thiophenic compounds
1077 23 24 0 0 1 12 332.252 0.000473 Thiophenic compounds
1078 27 24 0 0 1 16 380.252 0.000491 Thiophenic compounds
1079 29 24 0 0 1 18 404.252 0.003259 Thiophenic compounds
1080 16 26 0 0 1 4 250.268 0.000302 Thiophenic compounds
1081 17 26 0 0 1 5 262.268 0.000785 Thiophenic compounds
1082 18 26 0 0 1 6 274.268 0.027468 Thiophenic compounds
1083 19 26 0 0 1 7 286.268 0.036253 Thiophenic compounds
1084 20 26 0 0 1 8 298.268 0.020461 Thiophenic compounds
1085 21 26 0 0 1 9 310.268 0.011876 Thiophenic compounds
1086 22 26 0 0 1 10 322.268 0.012497 Thiophenic compounds
1087 23 26 0 0 1 11 334.268 0.002502 Thiophenic compounds
1088 24 26 0 0 1 12 346.268 0.00055 Thiophenic compounds
1089 26 26 0 0 1 14 370.268 0.001727 Thiophenic compounds
1090 28 26 0 0 1 16 394.268 0.000245 Thiophenic compounds
1091 31 26 0 0 1 19 430.268 0.000271 Thiophenic compounds
1092 16 28 0 0 1 3 252.284 0.000129 Thiophenic compounds
1093 17 28 0 0 1 4 264.284 0.000448 Thiophenic compounds
1094 18 28 0 0 1 5 276.284 0.001964 Thiophenic compounds
1095 19 28 0 0 1 6 288.284 0.024415 Thiophenic compounds
1096 20 28 0 0 1 7 300.284 0.033725 Thiophenic compounds
1097 21 28 0 0 1 8 312.284 0.022734 Thiophenic compounds
1098 22 28 0 0 1 9 324.284 0.008741 Thiophenic compounds
1099 23 28 0 0 1 10 336.284 0.010195 Thiophenic compounds
1100 24 28 0 0 1 11 348.284 0.003674 Thiophenic compounds
1101 25 28 0 0 1 12 360.284 0.00103 Thiophenic compounds
1102 26 28 0 0 1 13 372.284 0.000862 Thiophenic compounds
1103 29 28 0 0 1 16 408.284 0.000486 Thiophenic compounds
1104 14 30 0 0 1 0 230.3 0.000128 Thiophenic compounds
1105 16 30 0 0 1 2 254.3 4.4e-05 Thiophenic compounds
1106 17 30 0 0 1 3 266.3 0.000242 Thiophenic compounds
1107 18 30 0 0 1 4 278.3 0.001011 Thiophenic compounds
1108 19 30 0 0 1 5 290.3 0.002304 Thiophenic compounds
1109 20 30 0 0 1 6 302.3 0.016898 Thiophenic compounds
1110 21 30 0 0 1 7 314.3 0.026412 Thiophenic compounds
1111 22 30 0 0 1 8 326.3 0.027595 Thiophenic compounds
1112 23 30 0 0 1 9 338.3 0.011783 Thiophenic compounds
1113 24 30 0 0 1 10 350.3 0.007451 Thiophenic compounds
1114 25 30 0 0 1 11 362.3 0.004318 Thiophenic compounds
1115 26 30 0 0 1 12 374.3 0.001429 Thiophenic compounds
1116 27 30 0 0 1 13 386.3 0.00017 Thiophenic compounds
1117 30 30 0 0 1 16 422.3 0.000262 Thiophenic compounds
1118 43 30 0 0 1 29 578.3 9.9e-05 Thiophenic compounds
1119 18 32 0 0 1 3 280.316 0.000478 Thiophenic compounds
1120 19 32 0 0 1 4 292.316 0.001508 Thiophenic compounds
1121 20 32 0 0 1 5 304.316 0.002348 Thiophenic compounds
1122 21 32 0 0 1 6 316.316 0.0103 Thiophenic compounds
1123 22 32 0 0 1 7 328.316 0.022332 Thiophenic compounds
1124 23 32 0 0 1 8 340.316 0.030564 Thiophenic compounds
1125 24 32 0 0 1 9 352.316 0.015508 Thiophenic compounds
1126 25 32 0 0 1 10 364.316 0.006452 Thiophenic compounds
1127 26 32 0 0 1 11 376.316 0.003865 Thiophenic compounds
1128 27 32 0 0 1 12 388.316 0.00178 Thiophenic compounds
1129 28 32 0 0 1 13 400.316 0.00029 Thiophenic compounds
1130 29 32 0 0 1 14 412.316 0.000138 Thiophenic compounds
1131 31 32 0 0 1 16 436.316 0.000538 Thiophenic compounds
1132 16 34 0 0 1 0 258.332 0.000231 Thiophenic compounds
1133 18 34 0 0 1 2 282.332 0.000161 Thiophenic compounds
1134 19 34 0 0 1 3 294.332 0.000984 Thiophenic compounds
1135 20 34 0 0 1 4 306.332 0.001156 Thiophenic compounds
1136 21 34 0 0 1 5 318.332 0.002587 Thiophenic compounds
1137 22 34 0 0 1 6 330.332 0.006707 Thiophenic compounds
1138 23 34 0 0 1 7 342.332 0.018241 Thiophenic compounds
1139 24 34 0 0 1 8 354.332 0.027429 Thiophenic compounds
1140 25 34 0 0 1 9 366.332 0.015988 Thiophenic compounds
1141 26 34 0 0 1 10 378.332 0.006644 Thiophenic compounds
1142 27 34 0 0 1 11 390.332 0.003293 Thiophenic compounds
1143 28 34 0 0 1 12 402.332 0.00144 Thiophenic compounds
1144 29 34 0 0 1 13 414.332 0.00018 Thiophenic compounds
1145 32 34 0 0 1 16 450.332 0.000698 Thiophenic compounds
1146 33 34 0 0 1 17 462.332 0.000138 Thiophenic compounds
1147 19 36 0 0 1 2 296.348 9.3e-05 Thiophenic compounds
1148 20 36 0 0 1 3 308.348 0.000993 Thiophenic compounds
1149 21 36 0 0 1 4 320.348 0.001145 Thiophenic compounds
1150 22 36 0 0 1 5 332.348 0.002037 Thiophenic compounds
1151 23 36 0 0 1 6 344.348 0.004764 Thiophenic compounds
1152 24 36 0 0 1 7 356.348 0.015094 Thiophenic compounds
1153 25 36 0 0 1 8 368.348 0.023295 Thiophenic compounds
1154 26 36 0 0 1 9 380.348 0.015859 Thiophenic compounds
1155 27 36 0 0 1 10 392.348 0.005416 Thiophenic compounds
1156 28 36 0 0 1 11 404.348 0.003434 Thiophenic compounds
1157 29 36 0 0 1 12 416.348 0.001554 Thiophenic compounds
1158 30 36 0 0 1 13 428.348 0.000357 Thiophenic compounds
1159 33 36 0 0 1 16 464.348 0.004103 Thiophenic compounds
1160 20 38 0 0 1 2 310.364 0.000425 Thiophenic compounds
1161 21 38 0 0 1 3 322.364 0.001581 Thiophenic compounds
1162 22 38 0 0 1 4 334.364 0.000832 Thiophenic compounds
1163 23 38 0 0 1 5 346.364 0.001148 Thiophenic compounds
1164 24 38 0 0 1 6 358.364 0.003305 Thiophenic compounds
1165 25 38 0 0 1 7 370.364 0.012596 Thiophenic compounds
1166 26 38 0 0 1 8 382.364 0.018699 Thiophenic compounds
1167 27 38 0 0 1 9 394.364 0.013257 Thiophenic compounds
1168 28 38 0 0 1 10 406.364 0.005402 Thiophenic compounds
1169 29 38 0 0 1 11 418.364 0.002818 Thiophenic compounds
1170 30 38 0 0 1 12 430.364 0.00072 Thiophenic compounds
1171 31 38 0 0 1 13 442.364 0.00026 Thiophenic compounds
1172 34 38 0 0 1 16 478.364 0.001904 Thiophenic compounds
1173 35 38 0 0 1 17 490.364 0.000252 Thiophenic compounds
1174 21 40 0 0 1 2 324.38 0.000289 Thiophenic compounds
1175 22 40 0 0 1 3 336.38 0.000933 Thiophenic compounds
1176 23 40 0 0 1 4 348.38 0.000592 Thiophenic compounds
1177 24 40 0 0 1 5 360.38 0.000866 Thiophenic compounds
1178 25 40 0 0 1 6 372.38 0.002342 Thiophenic compounds
1179 26 40 0 0 1 7 384.38 0.009428 Thiophenic compounds
1180 27 40 0 0 1 8 396.38 0.01363 Thiophenic compounds
1181 28 40 0 0 1 9 408.38 0.009603 Thiophenic compounds
1182 29 40 0 0 1 10 420.38 0.004642 Thiophenic compounds
1183 30 40 0 0 1 11 432.38 0.002558 Thiophenic compounds
1184 31 40 0 0 1 12 444.38 0.000958 Thiophenic compounds
1185 32 40 0 0 1 13 456.38 0.000217 Thiophenic compounds
1186 33 40 0 0 1 14 468.38 0.000146 Thiophenic compounds
1187 35 40 0 0 1 16 492.38 0.003063 Thiophenic compounds
1188 36 40 0 0 1 17 504.38 0.000212 Thiophenic compounds
1189 22 42 0 0 1 2 338.396 9.8e-05 Thiophenic compounds
1190 23 42 0 0 1 3 350.396 0.000619 Thiophenic compounds
1191 24 42 0 0 1 4 362.396 0.00016 Thiophenic compounds
1192 25 42 0 0 1 5 374.396 0.000278 Thiophenic compounds
1193 26 42 0 0 1 6 386.396 0.001563 Thiophenic compounds
1194 27 42 0 0 1 7 398.396 0.006794 Thiophenic compounds
1195 28 42 0 0 1 8 410.396 0.009171 Thiophenic compounds
1196 29 42 0 0 1 9 422.396 0.007025 Thiophenic compounds
1197 30 42 0 0 1 10 434.396 0.004368 Thiophenic compounds
1198 31 42 0 0 1 11 446.396 0.001477 Thiophenic compounds
1199 32 42 0 0 1 12 458.396 0.001159 Thiophenic compounds
1200 33 42 0 0 1 13 470.396 0.000197 Thiophenic compounds
1201 34 42 0 0 1 14 482.396 7.9e-05 Thiophenic compounds
1202 35 42 0 0 1 15 494.396 0.000178 Thiophenic compounds
1203 36 42 0 0 1 16 506.396 0.002072 Thiophenic compounds
1204 23 44 0 0 1 2 352.412 0.000102 Thiophenic compounds
1205 24 44 0 0 1 3 364.412 0.000288 Thiophenic compounds
1206 25 44 0 0 1 4 376.412 0.000121 Thiophenic compounds
1207 26 44 0 0 1 5 388.412 0.000591 Thiophenic compounds
1208 27 44 0 0 1 6 400.412 0.001165 Thiophenic compounds
1209 28 44 0 0 1 7 412.412 0.003967 Thiophenic compounds
1210 29 44 0 0 1 8 424.412 0.006306 Thiophenic compounds
1211 30 44 0 0 1 9 436.412 0.005131 Thiophenic compounds
1212 31 44 0 0 1 10 448.412 0.00304 Thiophenic compounds
1213 32 44 0 0 1 11 460.412 0.001765 Thiophenic compounds
1214 33 44 0 0 1 12 472.412 0.000405 Thiophenic compounds
1215 34 44 0 0 1 13 484.412 0.000148 Thiophenic compounds
1216 36 44 0 0 1 15 508.412 0.000235 Thiophenic compounds
1217 37 44 0 0 1 16 520.412 0.002929 Thiophenic compounds
1218 38 44 0 0 1 17 532.412 0.000158 Thiophenic compounds
1219 22 46 0 0 1 0 342.428 8.4e-05 Thiophenic compounds
1220 24 46 0 0 1 2 366.428 9.2e-05 Thiophenic compounds
1221 25 46 0 0 1 3 378.428 0.00024 Thiophenic compounds
1222 26 46 0 0 1 4 390.428 0.000135 Thiophenic compounds
1223 27 46 0 0 1 5 402.428 0.000348 Thiophenic compounds
1224 28 46 0 0 1 6 414.428 0.000664 Thiophenic compounds
1225 29 46 0 0 1 7 426.428 0.003165 Thiophenic compounds
1226 30 46 0 0 1 8 438.428 0.004287 Thiophenic compounds
1227 31 46 0 0 1 9 450.428 0.003487 Thiophenic compounds
1228 32 46 0 0 1 10 462.428 0.002129 Thiophenic compounds
1229 33 46 0 0 1 11 474.428 0.001087 Thiophenic compounds
1230 34 46 0 0 1 12 486.428 0.000456 Thiophenic compounds
1231 35 46 0 0 1 13 498.428 0.000173 Thiophenic compounds
1232 36 46 0 0 1 14 510.428 0.000139 Thiophenic compounds
1233 37 46 0 0 1 15 522.428 0.000247 Thiophenic compounds
1234 38 46 0 0 1 16 534.428 0.001848 Thiophenic compounds
1235 39 46 0 0 1 17 546.428 0.000102 Thiophenic compounds
1236 26 48 0 0 1 3 392.444 0.000128 Thiophenic compounds
1237 27 48 0 0 1 4 404.444 0.000118 Thiophenic compounds
1238 29 48 0 0 1 6 428.444 0.000321 Thiophenic compounds
1239 30 48 0 0 1 7 440.444 0.002174 Thiophenic compounds
1240 31 48 0 0 1 8 452.444 0.002827 Thiophenic compounds
1241 32 48 0 0 1 9 464.444 0.002431 Thiophenic compounds
1242 33 48 0 0 1 10 476.444 0.001632 Thiophenic compounds
1243 34 48 0 0 1 11 488.444 0.000625 Thiophenic compounds
1244 36 48 0 0 1 13 512.444 0.000157 Thiophenic compounds
1245 37 48 0 0 1 14 524.444 0.00026 Thiophenic compounds
1246 38 48 0 0 1 15 536.444 0.0002 Thiophenic compounds
1247 39 48 0 0 1 16 548.444 0.001136 Thiophenic compounds
1248 40 48 0 0 1 17 560.444 0.000164 Thiophenic compounds
1249 27 50 0 0 1 3 406.46 0.000119 Thiophenic compounds
1250 30 50 0 0 1 6 442.46 0.000263 Thiophenic compounds
1251 31 50 0 0 1 7 454.46 0.001161 Thiophenic compounds
1252 32 50 0 0 1 8 466.46 0.00173 Thiophenic compounds
1253 33 50 0 0 1 9 478.46 0.001179 Thiophenic compounds
1254 34 50 0 0 1 10 490.46 0.000758 Thiophenic compounds
1255 35 50 0 0 1 11 502.46 0.00045 Thiophenic compounds
1256 36 50 0 0 1 12 514.46 0.000139 Thiophenic compounds
1257 39 50 0 0 1 15 550.46 0.000187 Thiophenic compounds
1258 40 50 0 0 1 16 562.46 0.001006 Thiophenic compounds
1259 30 52 0 0 1 5 444.476 7.3e-05 Thiophenic compounds
1260 31 52 0 0 1 6 456.476 0.000218 Thiophenic compounds
1261 32 52 0 0 1 7 468.476 0.000616 Thiophenic compounds
1262 33 52 0 0 1 8 480.476 0.000664 Thiophenic compounds
1263 34 52 0 0 1 9 492.476 0.00121 Thiophenic compounds
1264 35 52 0 0 1 10 504.476 0.000765 Thiophenic compounds
1265 37 52 0 0 1 12 528.476 0.000186 Thiophenic compounds
1266 41 52 0 0 1 16 576.476 0.000336 Thiophenic compounds
1267 32 54 0 0 1 6 470.492 0.000136 Thiophenic compounds
1268 33 54 0 0 1 7 482.492 0.000313 Thiophenic compounds
1269 34 54 0 0 1 8 494.492 0.000346 Thiophenic compounds
1270 35 54 0 0 1 9 506.492 0.000571 Thiophenic compounds
1271 36 54 0 0 1 10 518.492 0.000428 Thiophenic compounds
1272 38 54 0 0 1 12 542.492 0.000138 Thiophenic compounds
1273 40 54 0 0 1 14 566.492 0.000265 Thiophenic compounds
1274 56 54 0 0 1 30 758.492 0.00013 Thiophenic compounds
1275 34 56 0 0 1 7 496.508 0.000156 Thiophenic compounds
1276 35 56 0 0 1 8 508.508 0.000179 Thiophenic compounds
1277 36 56 0 0 1 9 520.508 0.000311 Thiophenic compounds
1278 37 56 0 0 1 10 532.508 0.000383 Thiophenic compounds
1279 40 56 0 0 1 13 568.508 0.000261 Thiophenic compounds
1280 41 56 0 0 1 14 580.508 0.000159 Thiophenic compounds
1281 42 56 0 0 1 15 592.508 0.000207 Thiophenic compounds
1282 43 56 0 0 1 16 604.508 0.000153 Thiophenic compounds
1283 46 56 0 0 1 19 640.508 0.000122 Thiophenic compounds
1284 55 56 0 0 1 28 748.508 0.000129 Thiophenic compounds
1285 34 58 0 0 1 6 498.524 0.000139 Thiophenic compounds
1286 35 58 0 0 1 7 510.524 0.000189 Thiophenic compounds
1287 36 58 0 0 1 8 522.524 0.000106 Thiophenic compounds
1288 37 58 0 0 1 9 534.524 0.000298 Thiophenic compounds
1289 38 58 0 0 1 10 546.524 0.000271 Thiophenic compounds
1290 38 60 0 0 1 9 548.54 0.000355 Thiophenic compounds
1291 39 60 0 0 1 10 560.54 0.000348 Thiophenic compounds
1292 45 60 0 0 1 16 632.54 0.000167 Thiophenic compounds
1293 39 62 0 0 1 9 562.556 0.000468 Thiophenic compounds
1294 40 62 0 0 1 10 574.556 0.000476 Thiophenic compounds
1295 55 62 0 0 1 25 754.556 0.000129 Thiophenic compounds
1296 35 64 0 0 1 4 516.572 0.000126 Thiophenic compounds
1297 40 64 0 0 1 9 576.572 0.00178 Thiophenic compounds
1298 41 64 0 0 1 10 588.572 0.000189 Thiophenic compounds
1299 41 66 0 0 1 9 590.588 0.000292 Thiophenic compounds
1300 41 68 0 0 1 8 592.604 0.000123 Thiophenic compounds
1301 42 68 0 0 1 9 604.604 0.001316 Thiophenic compounds
1302 49 68 0 0 1 16 688.604 0.00014 Thiophenic compounds
1303 53 68 0 0 1 20 736.604 0.000732 Thiophenic compounds
1304 45 70 0 0 1 11 642.62 0.000105 Thiophenic compounds
1305 44 72 0 0 1 9 632.636 0.000478 Thiophenic compounds
1306 51 74 0 0 1 15 718.652 0.000126 Thiophenic compounds
1307 12 12 2 0 0 7 188.096 5.9e-05 Acidic fraction
1308 15 12 1 0 0 10 208.096 0.000142 Acidic fraction
1309 13 12 2 0 0 8 200.096 5.1e-05 Acidic fraction
1310 14 12 2 0 0 9 212.096 0.000216 Acidic fraction
1311 18 12 1 0 0 13 244.096 6.5e-05 Acidic fraction
1312 15 12 2 0 0 10 224.096 9.9e-05 Acidic fraction
1313 11 14 1 0 0 5 162.112 5.1e-05 Acidic fraction
1314 12 14 1 0 0 6 174.112 8.2e-05 Acidic fraction
1315 10 14 2 0 0 4 166.112 3.7e-05 Acidic fraction
1316 13 14 1 0 0 7 186.112 0.000181 Acidic fraction
1317 14 14 1 0 0 8 198.112 0.000352 Acidic fraction
1318 11 14 2 0 0 5 178.112 0.000107 Acidic fraction
1319 15 14 1 0 0 9 210.112 0.000398 Acidic fraction
1320 12 14 2 0 0 6 190.112 5.2e-05 Acidic fraction
1321 13 14 2 0 0 7 202.112 8.9e-05 Acidic fraction
1322 16 14 1 0 0 10 222.112 0.000225 Acidic fraction
1323 17 14 1 0 0 11 234.112 0.000365 Acidic fraction
1324 14 14 2 0 0 8 214.112 9e-05 Acidic fraction
1325 18 14 1 0 0 12 246.112 9.8e-05 Acidic fraction
1326 15 14 2 0 0 9 226.112 0.000439 Acidic fraction
1327 19 14 1 0 0 13 258.112 5.9e-05 Acidic fraction
1328 16 14 2 0 0 10 238.112 0.00019 Acidic fraction
1329 11 16 1 0 0 4 164.128 3.8e-05 Acidic fraction
1330 12 16 1 0 0 5 176.128 7.2e-05 Acidic fraction
1331 13 16 1 0 0 6 188.128 0.000152 Acidic fraction
1332 12 16 3 0 0 5 208.128 5.7e-05 Acidic fraction
1333 11 16 2 0 0 4 180.128 4.6e-05 Acidic fraction
1334 14 16 1 0 0 7 200.128 0.000262 Acidic fraction
1335 12 16 2 0 0 5 192.128 4.9e-05 Acidic fraction
1336 15 16 1 0 0 8 212.128 0.000707 Acidic fraction
1337 16 16 1 0 0 9 224.128 0.00137 Acidic fraction
1338 13 16 2 0 0 6 204.128 0.000101 Acidic fraction
1339 17 16 1 0 0 10 236.128 0.000604 Acidic fraction
1340 14 16 2 0 0 7 216.128 0.000122 Acidic fraction
1341 18 16 1 0 0 11 248.128 0.00106 Acidic fraction
1342 15 16 2 0 0 8 228.128 0.000281 Acidic fraction
1343 19 16 1 0 0 12 260.128 0.000148 Acidic fraction
1344 16 16 2 0 0 9 240.128 0.000561 Acidic fraction
1345 20 16 1 0 0 13 272.128 7.8e-05 Acidic fraction
1346 21 16 1 0 0 14 284.128 8e-05 Acidic fraction
1347 17 16 2 0 0 10 252.128 0.000214 Acidic fraction
1348 18 16 2 0 0 11 264.128 9e-05 Acidic fraction
1349 9 18 2 0 0 1 158.144 7.7e-05 Acidic fraction
1350 12 18 1 0 0 4 178.144 7.2e-05 Acidic fraction
1351 10 18 2 0 0 2 170.144 3.8e-05 Acidic fraction
1352 13 18 1 0 0 5 190.144 0.000263 Acidic fraction
1353 11 18 2 0 0 3 182.144 4.7e-05 Acidic fraction
1354 14 18 1 0 0 6 202.144 0.00069 Acidic fraction
1355 13 18 3 0 0 5 222.144 8.1e-05 Acidic fraction
1356 12 18 2 0 0 4 194.144 8.4e-05 Acidic fraction
1357 15 18 1 0 0 7 214.144 0.000627 Acidic fraction
1358 13 18 2 0 0 5 206.144 8.8e-05 Acidic fraction
1359 16 18 1 0 0 8 226.144 0.002108 Acidic fraction
1360 17 18 1 0 0 9 238.144 0.003504 Acidic fraction
1361 14 18 2 0 0 6 218.144 0.000228 Acidic fraction
1362 18 18 1 0 0 10 250.144 0.001268 Acidic fraction
1363 15 18 2 0 0 7 230.144 0.000725 Acidic fraction
1364 19 18 1 0 0 11 262.144 0.001609 Acidic fraction
1365 16 18 2 0 0 8 242.144 0.000524 Acidic fraction
1366 20 18 1 0 0 12 274.144 0.000342 Acidic fraction
1367 17 18 2 0 0 9 254.144 0.000468 Acidic fraction
1368 21 18 1 0 0 13 286.144 0.000348 Acidic fraction
1369 22 18 1 0 0 14 298.144 7.5e-05 Acidic fraction
1370 18 18 2 0 0 10 266.144 0.000308 Acidic fraction
1371 19 18 2 0 0 11 278.144 0.000134 Acidic fraction
1372 10 20 2 0 0 1 172.16 8e-05 Acidic fraction
1373 13 20 1 0 0 4 192.16 9.7e-05 Acidic fraction
1374 11 20 2 0 0 2 184.16 4.8e-05 Acidic fraction
1375 14 20 1 0 0 5 204.16 0.000769 Acidic fraction
1376 12 20 2 0 0 3 196.16 0.000419 Acidic fraction
1377 13 20 3 0 0 4 224.16 6.1e-05 Acidic fraction
1378 15 20 1 0 0 6 216.16 0.002106 Acidic fraction
1379 14 20 3 0 0 5 236.16 6.2e-05 Acidic fraction
1380 13 20 2 0 0 4 208.16 0.00092 Acidic fraction
1381 16 20 1 0 0 7 228.16 0.003004 Acidic fraction
1382 14 20 2 0 0 5 220.16 0.000654 Acidic fraction
1383 17 20 1 0 0 8 240.16 0.00496 Acidic fraction
1384 16 20 3 0 0 7 260.16 7.2e-05 Acidic fraction
1385 18 20 1 0 0 9 252.16 0.006945 Acidic fraction
1386 15 20 2 0 0 6 232.16 0.001 Acidic fraction
1387 19 20 1 0 0 10 264.16 0.002062 Acidic fraction
1388 16 20 2 0 0 7 244.16 0.00238 Acidic fraction
1389 20 20 1 0 0 11 276.16 0.003129 Acidic fraction
1390 17 20 2 0 0 8 256.16 0.001007 Acidic fraction
1391 21 20 1 0 0 12 288.16 0.000953 Acidic fraction
1392 18 20 2 0 0 9 268.16 0.000698 Acidic fraction
1393 22 20 1 0 0 13 300.16 0.000494 Acidic fraction
1394 23 20 1 0 0 14 312.16 9.9e-05 Acidic fraction
1395 19 20 2 0 0 10 280.16 0.000524 Acidic fraction
1396 20 20 2 0 0 11 292.16 0.000162 Acidic fraction
1397 12 22 1 0 0 2 182.176 0.000121 Acidic fraction
1398 11 22 2 0 0 1 186.176 4.7e-05 Acidic fraction
1399 14 22 1 0 0 4 206.176 0.000431 Acidic fraction
1400 12 22 2 0 0 2 198.176 0.000141 Acidic fraction
1401 15 22 1 0 0 5 218.176 0.001922 Acidic fraction
1402 13 22 2 0 0 3 210.176 0.001649 Acidic fraction
1403 14 22 3 0 0 4 238.176 9.6e-05 Acidic fraction
1404 16 22 1 0 0 6 230.176 0.011479 Acidic fraction
1405 14 22 2 0 0 4 222.176 0.007942 Acidic fraction
1406 17 22 1 0 0 7 242.176 0.011758 Acidic fraction
1407 15 22 3 0 0 5 250.176 0.000112 Acidic fraction
1408 15 22 2 0 0 5 234.176 0.00788 Acidic fraction
1409 18 22 1 0 0 8 254.176 0.006958 Acidic fraction
1410 17 22 3 0 0 7 274.176 0.000116 Acidic fraction
1411 19 22 1 0 0 9 266.176 0.009078 Acidic fraction
1412 16 22 2 0 0 6 246.176 0.00336 Acidic fraction
1413 20 22 1 0 0 10 278.176 0.004894 Acidic fraction
1414 17 22 2 0 0 7 258.176 0.004003 Acidic fraction
1415 21 22 1 0 0 11 290.176 0.004355 Acidic fraction
1416 18 22 3 0 0 8 286.176 8.3e-05 Acidic fraction
1417 18 22 2 0 0 8 270.176 0.001893 Acidic fraction
1418 22 22 1 0 0 12 302.176 0.001181 Acidic fraction
1419 19 22 2 0 0 9 282.176 0.001143 Acidic fraction
1420 19 22 3 0 0 9 298.176 0.000163 Acidic fraction
1421 23 22 1 0 0 13 314.176 0.000419 Acidic fraction
1422 24 22 1 0 0 14 326.176 0.000113 Acidic fraction
1423 20 22 2 0 0 10 294.176 0.0007 Acidic fraction
1424 21 22 2 0 0 11 306.176 0.000196 Acidic fraction
1425 13 24 1 0 0 2 196.192 4.1e-05 Acidic fraction
1426 12 24 2 0 0 1 200.192 0.000286 Acidic fraction
1427 15 24 1 0 0 4 220.192 0.00059 Acidic fraction
1428 13 24 2 0 0 2 212.192 0.000409 Acidic fraction
1429 16 24 1 0 0 5 232.192 0.006296 Acidic fraction
1430 14 24 2 0 0 3 224.192 0.00936 Acidic fraction
1431 15 24 3 0 0 4 252.192 9.3e-05 Acidic fraction
1432 17 24 1 0 0 6 244.192 0.02982 Acidic fraction
1433 15 24 2 0 0 4 236.192 0.051494 Acidic fraction
1434 18 24 1 0 0 7 256.192 0.019952 Acidic fraction
1435 16 24 3 0 0 5 264.192 6.9e-05 Acidic fraction
1436 17 24 3 0 0 6 276.192 8.2e-05 Acidic fraction
1437 19 24 1 0 0 8 268.192 0.012454 Acidic fraction
1438 16 24 2 0 0 5 248.192 0.039946 Acidic fraction
1439 18 24 3 0 0 7 288.192 7.3e-05 Acidic fraction
1440 20 24 1 0 0 9 280.192 0.023147 Acidic fraction
1441 17 24 2 0 0 6 260.192 0.009526 Acidic fraction
1442 21 24 1 0 0 10 292.192 0.008288 Acidic fraction
1443 18 24 2 0 0 7 272.192 0.006424 Acidic fraction
1444 22 24 1 0 0 11 304.192 0.003347 Acidic fraction
1445 19 24 2 0 0 8 284.192 0.003815 Acidic fraction
1446 19 24 3 0 0 8 300.192 0.000102 Acidic fraction
1447 23 24 1 0 0 12 316.192 0.001094 Acidic fraction
1448 20 24 2 0 0 9 296.192 0.001522 Acidic fraction
1449 20 24 3 0 0 9 312.192 0.000501 Acidic fraction
1450 24 24 1 0 0 13 328.192 0.000248 Acidic fraction
1451 25 24 1 0 0 14 340.192 0.000114 Acidic fraction
1452 21 24 2 0 0 10 308.192 0.00055 Acidic fraction
1453 22 24 2 0 0 11 320.192 0.000143 Acidic fraction
1454 14 26 1 0 0 2 210.208 4.7e-05 Acidic fraction
1455 13 26 2 0 0 1 214.208 0.000192 Acidic fraction
1456 15 26 1 0 0 3 222.208 5.5e-05 Acidic fraction
1457 16 26 1 0 0 4 234.208 0.001462 Acidic fraction
1458 14 26 2 0 0 2 226.208 0.001586 Acidic fraction
1459 17 26 1 0 0 5 246.208 0.013585 Acidic fraction
1460 15 26 2 0 0 3 238.208 0.040412 Acidic fraction
1461 16 26 3 0 0 4 266.208 8.5e-05 Acidic fraction
1462 18 26 1 0 0 6 258.208 0.038214 Acidic fraction
1463 16 26 2 0 0 4 250.208 0.14445 Acidic fraction
1464 19 26 1 0 0 7 270.208 0.034445 Acidic fraction
1465 17 26 3 0 0 5 278.208 8.3e-05 Acidic fraction
1466 18 26 3 0 0 6 290.208 0.000129 Acidic fraction
1467 20 26 1 0 0 8 282.208 0.025703 Acidic fraction
1468 17 26 2 0 0 5 262.208 0.049941 Acidic fraction
1469 19 26 3 0 0 7 302.208 0.000173 Acidic fraction
1470 21 26 1 0 0 9 294.208 0.032276 Acidic fraction
1471 18 26 2 0 0 6 274.208 0.023532 Acidic fraction
1472 22 26 1 0 0 10 306.208 0.009228 Acidic fraction
1473 19 26 2 0 0 7 286.208 0.009557 Acidic fraction
1474 23 26 1 0 0 11 318.208 0.002419 Acidic fraction
1475 20 26 2 0 0 8 298.208 0.00423 Acidic fraction
1476 20 26 3 0 0 8 314.208 0.000375 Acidic fraction
1477 24 26 1 0 0 12 330.208 0.000697 Acidic fraction
1478 21 26 2 0 0 9 310.208 0.001285 Acidic fraction
1479 25 26 1 0 0 13 342.208 0.000191 Acidic fraction
1480 21 26 3 0 0 9 326.208 0.000379 Acidic fraction
1481 22 26 2 0 0 10 322.208 0.000524 Acidic fraction
1482 26 26 1 0 0 14 354.208 9e-05 Acidic fraction
1483 23 26 2 0 0 11 334.208 0.000155 Acidic fraction
1484 15 28 1 0 0 2 224.224 5.6e-05 Acidic fraction
1485 16 28 1 0 0 3 236.224 5.8e-05 Acidic fraction
1486 14 28 2 0 0 1 228.224 0.002105 Acidic fraction
1487 17 28 1 0 0 4 248.224 0.002839 Acidic fraction
1488 15 28 2 0 0 2 240.224 0.003995 Acidic fraction
1489 18 28 1 0 0 5 260.224 0.020209 Acidic fraction
1490 16 28 2 0 0 3 252.224 0.089177 Acidic fraction
1491 19 28 1 0 0 6 272.224 0.060556 Acidic fraction
1492 17 28 2 0 0 4 264.224 0.127156 Acidic fraction
1493 20 28 1 0 0 7 284.224 0.086505 Acidic fraction
1494 18 28 3 0 0 5 292.224 8.6e-05 Acidic fraction
1495 19 28 3 0 0 6 304.224 8.1e-05 Acidic fraction
1496 21 28 1 0 0 8 296.224 0.038403 Acidic fraction
1497 18 28 2 0 0 5 276.224 0.10195 Acidic fraction
1498 22 28 1 0 0 9 308.224 0.022893 Acidic fraction
1499 19 28 2 0 0 6 288.224 0.032331 Acidic fraction
1500 23 28 1 0 0 10 320.224 0.007127 Acidic fraction
1501 20 28 2 0 0 7 300.224 0.009365 Acidic fraction
1502 24 28 1 0 0 11 332.224 0.001837 Acidic fraction
1503 21 28 2 0 0 8 312.224 0.002676 Acidic fraction
1504 25 28 1 0 0 12 344.224 0.000528 Acidic fraction
1505 22 28 2 0 0 9 324.224 0.000902 Acidic fraction
1506 26 28 1 0 0 13 356.224 0.000132 Acidic fraction
1507 23 28 2 0 0 10 336.224 0.000313 Acidic fraction
1508 22 28 3 0 0 9 340.224 0.000171 Acidic fraction
1509 24 28 2 0 0 11 348.224 0.000121 Acidic fraction
1510 17 30 1 0 0 3 250.24 8.7e-05 Acidic fraction
1511 15 30 2 0 0 1 242.24 0.001829 Acidic fraction
1512 18 30 1 0 0 4 262.24 0.003704 Acidic fraction
1513 16 30 2 0 0 2 254.24 0.005499 Acidic fraction
1514 19 30 1 0 0 5 274.24 0.030315 Acidic fraction
1515 17 30 2 0 0 3 266.24 0.059763 Acidic fraction
1516 20 30 1 0 0 6 286.24 0.103943 Acidic fraction
1517 18 30 2 0 0 4 278.24 0.198695 Acidic fraction
1518 21 30 1 0 0 7 298.24 0.081331 Acidic fraction
1519 22 30 1 0 0 8 310.24 0.029603 Acidic fraction
1520 19 30 2 0 0 5 290.24 0.1221 Acidic fraction
1521 23 30 1 0 0 9 322.24 0.014243 Acidic fraction
1522 20 30 2 0 0 6 302.24 0.022787 Acidic fraction
1523 24 30 1 0 0 10 334.24 0.004807 Acidic fraction
1524 21 30 2 0 0 7 314.24 0.005618 Acidic fraction
1525 25 30 1 0 0 11 346.24 0.001167 Acidic fraction
1526 22 30 2 0 0 8 326.24 0.001935 Acidic fraction
1527 26 30 1 0 0 12 358.24 0.000305 Acidic fraction
1528 23 30 2 0 0 9 338.24 0.000833 Acidic fraction
1529 24 30 2 0 0 10 350.24 0.00023 Acidic fraction
1530 16 32 2 0 0 1 256.256 0.020009 Acidic fraction
1531 19 32 1 0 0 4 276.256 0.009139 Acidic fraction
1532 17 32 2 0 0 2 268.256 0.006819 Acidic fraction
1533 20 32 1 0 0 5 288.256 0.065956 Acidic fraction
1534 18 32 2 0 0 3 280.256 0.109578 Acidic fraction
1535 21 32 1 0 0 6 300.256 0.096565 Acidic fraction
1536 19 32 2 0 0 4 292.256 0.185443 Acidic fraction
1537 22 32 1 0 0 7 312.256 0.046333 Acidic fraction
1538 23 32 1 0 0 8 324.256 0.018883 Acidic fraction
1539 20 32 2 0 0 5 304.256 0.066807 Acidic fraction
1540 24 32 1 0 0 9 336.256 0.008758 Acidic fraction
1541 21 32 2 0 0 6 316.256 0.011407 Acidic fraction
1542 25 32 1 0 0 10 348.256 0.002589 Acidic fraction
1543 22 32 2 0 0 7 328.256 0.003475 Acidic fraction
1544 26 32 1 0 0 11 360.256 0.00059 Acidic fraction
1545 23 32 2 0 0 8 340.256 0.001115 Acidic fraction
1546 27 32 1 0 0 12 372.256 0.000152 Acidic fraction
1547 24 32 2 0 0 9 352.256 0.000551 Acidic fraction
1548 25 32 2 0 0 10 364.256 0.000127 Acidic fraction
1549 17 34 2 0 0 1 270.272 0.001015 Acidic fraction
1550 20 34 1 0 0 4 290.272 0.017381 Acidic fraction
1551 18 34 2 0 0 2 282.272 0.012899 Acidic fraction
1552 21 34 1 0 0 5 302.272 0.067072 Acidic fraction
1553 19 34 2 0 0 3 294.272 0.156697 Acidic fraction
1554 22 34 1 0 0 6 314.272 0.054645 Acidic fraction
1555 20 34 2 0 0 4 306.272 0.133163 Acidic fraction
1556 23 34 1 0 0 7 326.272 0.025475 Acidic fraction
1557 24 34 1 0 0 8 338.272 0.012331 Acidic fraction
1558 21 34 2 0 0 5 318.272 0.025883 Acidic fraction
1559 25 34 1 0 0 9 350.272 0.005103 Acidic fraction
1560 22 34 2 0 0 6 330.272 0.005729 Acidic fraction
1561 23 34 2 0 0 7 342.272 0.00203 Acidic fraction
1562 26 34 1 0 0 10 362.272 0.001278 Acidic fraction
1563 27 34 1 0 0 11 374.272 0.000296 Acidic fraction
1564 24 34 2 0 0 8 354.272 0.000831 Acidic fraction
1565 25 34 2 0 0 9 366.272 0.000234 Acidic fraction
1566 26 34 2 0 0 10 378.272 0.000144 Acidic fraction
1567 18 36 2 0 0 1 284.288 0.011638 Acidic fraction
1568 21 36 1 0 0 4 304.288 0.019349 Acidic fraction
1569 19 36 2 0 0 2 296.288 0.018273 Acidic fraction
1570 22 36 1 0 0 5 316.288 0.041491 Acidic fraction
1571 20 36 2 0 0 3 308.288 0.10591 Acidic fraction
1572 23 36 1 0 0 6 328.288 0.030214 Acidic fraction
1573 21 36 2 0 0 4 320.288 0.056653 Acidic fraction
1574 24 36 1 0 0 7 340.288 0.012855 Acidic fraction
1575 25 36 1 0 0 8 352.288 0.006017 Acidic fraction
1576 22 36 2 0 0 5 332.288 0.012988 Acidic fraction
1577 26 36 1 0 0 9 364.288 0.001965 Acidic fraction
1578 23 36 2 0 0 6 344.288 0.002938 Acidic fraction
1579 24 36 2 0 0 7 356.288 0.000938 Acidic fraction
1580 27 36 1 0 0 10 376.288 0.000542 Acidic fraction
1581 28 36 1 0 0 11 388.288 0.000207 Acidic fraction
1582 25 36 2 0 0 8 368.288 0.000367 Acidic fraction
1583 26 36 2 0 0 9 380.288 0.000111 Acidic fraction
1584 19 38 2 0 0 1 298.304 0.001167 Acidic fraction
1585 22 38 1 0 0 4 318.304 0.01495 Acidic fraction
1586 20 38 2 0 0 2 310.304 0.015837 Acidic fraction
1587 23 38 1 0 0 5 330.304 0.02474 Acidic fraction
1588 21 38 2 0 0 3 322.304 0.06945 Acidic fraction
1589 24 38 1 0 0 6 342.304 0.015233 Acidic fraction
1590 22 38 2 0 0 4 334.304 0.027162 Acidic fraction
1591 25 38 1 0 0 7 354.304 0.005822 Acidic fraction
1592 26 38 1 0 0 8 366.304 0.002544 Acidic fraction
1593 23 38 2 0 0 5 346.304 0.005704 Acidic fraction
1594 27 38 1 0 0 9 378.304 0.001014 Acidic fraction
1595 24 38 2 0 0 6 358.304 0.001323 Acidic fraction
1596 28 38 1 0 0 10 390.304 0.000285 Acidic fraction
1597 25 38 2 0 0 7 370.304 0.000517 Acidic fraction
1598 26 38 2 0 0 8 382.304 0.000196 Acidic fraction
1599 20 40 2 0 0 1 312.32 0.001234 Acidic fraction
1600 23 40 1 0 0 4 332.32 0.010557 Acidic fraction
1601 21 40 2 0 0 2 324.32 0.012639 Acidic fraction
1602 24 40 1 0 0 5 344.32 0.012869 Acidic fraction
1603 22 40 2 0 0 3 336.32 0.03237 Acidic fraction
1604 25 40 1 0 0 6 356.32 0.007058 Acidic fraction
1605 23 40 2 0 0 4 348.32 0.011497 Acidic fraction
1606 26 40 1 0 0 7 368.32 0.002196 Acidic fraction
1607 24 40 2 0 0 5 360.32 0.002657 Acidic fraction
1608 27 40 1 0 0 8 380.32 0.001099 Acidic fraction
1609 28 40 1 0 0 9 392.32 0.000428 Acidic fraction
1610 25 40 2 0 0 6 372.32 0.000794 Acidic fraction
1611 29 40 1 0 0 10 404.32 0.000162 Acidic fraction
1612 26 40 2 0 0 7 384.32 0.000324 Acidic fraction
1613 27 40 2 0 0 8 396.32 0.000114 Acidic fraction
1614 21 42 2 0 0 1 326.336 0.001171 Acidic fraction
1615 24 42 1 0 0 4 346.336 0.006394 Acidic fraction
1616 22 42 2 0 0 2 338.336 0.010469 Acidic fraction
1617 25 42 1 0 0 5 358.336 0.005869 Acidic fraction
1618 23 42 2 0 0 3 350.336 0.017569 Acidic fraction
1619 26 42 1 0 0 6 370.336 0.002773 Acidic fraction
1620 24 42 2 0 0 4 362.336 0.006061 Acidic fraction
1621 27 42 1 0 0 7 382.336 0.001132 Acidic fraction
1622 25 42 2 0 0 5 374.336 0.001395 Acidic fraction
1623 28 42 1 0 0 8 394.336 0.00049 Acidic fraction
1624 29 42 1 0 0 9 406.336 0.000207 Acidic fraction
1625 26 42 2 0 0 6 386.336 0.000512 Acidic fraction
1626 27 42 2 0 0 7 398.336 0.000191 Acidic fraction
1627 28 42 2 0 0 8 410.336 0.000187 Acidic fraction
1628 22 44 2 0 0 1 340.352 0.001437 Acidic fraction
1629 25 44 1 0 0 4 360.352 0.003199 Acidic fraction
1630 23 44 2 0 0 2 352.352 0.006634 Acidic fraction
1631 26 44 1 0 0 5 372.352 0.002506 Acidic fraction
1632 24 44 2 0 0 3 364.352 0.009091 Acidic fraction
1633 27 44 1 0 0 6 384.352 0.001334 Acidic fraction
1634 25 44 2 0 0 4 376.352 0.002872 Acidic fraction
1635 28 44 1 0 0 7 396.352 0.000354 Acidic fraction
1636 26 44 2 0 0 5 388.352 0.000565 Acidic fraction
1637 29 44 1 0 0 8 408.352 0.000137 Acidic fraction
1638 27 44 2 0 0 6 400.352 0.000178 Acidic fraction
1639 23 46 2 0 0 1 354.368 0.001306 Acidic fraction
1640 26 46 1 0 0 4 374.368 0.001547 Acidic fraction
1641 24 46 2 0 0 2 366.368 0.004732 Acidic fraction
1642 27 46 1 0 0 5 386.368 0.00147 Acidic fraction
1643 25 46 2 0 0 3 378.368 0.004108 Acidic fraction
1644 28 46 1 0 0 6 398.368 0.0005 Acidic fraction
1645 26 46 2 0 0 4 390.368 0.001345 Acidic fraction
1646 29 46 1 0 0 7 410.368 0.00016 Acidic fraction
1647 27 46 2 0 0 5 402.368 0.000312 Acidic fraction
1648 24 48 2 0 0 1 368.384 0.001026 Acidic fraction
1649 27 48 1 0 0 4 388.384 0.000807 Acidic fraction
1650 25 48 2 0 0 2 380.384 0.002466 Acidic fraction
1651 28 48 1 0 0 5 400.384 0.00062 Acidic fraction
1652 26 48 2 0 0 3 392.384 0.001992 Acidic fraction
1653 29 48 1 0 0 6 412.384 0.000203 Acidic fraction
1654 27 48 2 0 0 4 404.384 0.000698 Acidic fraction
1655 30 48 1 0 0 7 424.384 0.000111 Acidic fraction
1656 28 48 2 0 0 5 416.384 0.000265 Acidic fraction
1657 25 50 2 0 0 1 382.4 0.000706 Acidic fraction
1658 28 50 1 0 0 4 402.4 0.000465 Acidic fraction
1659 26 50 2 0 0 2 394.4 0.001323 Acidic fraction
1660 29 50 1 0 0 5 414.4 0.000313 Acidic fraction
1661 27 50 2 0 0 3 406.4 0.000977 Acidic fraction
1662 28 50 2 0 0 4 418.4 0.000411 Acidic fraction
1663 29 50 2 0 0 5 430.4 0.000156 Acidic fraction
1664 26 52 2 0 0 1 396.416 0.000564 Acidic fraction
1665 29 52 1 0 0 4 416.416 0.000153 Acidic fraction
1666 27 52 2 0 0 2 408.416 0.000355 Acidic fraction
1667 28 52 2 0 0 3 420.416 0.000601 Acidic fraction
1668 29 52 2 0 0 4 432.416 0.000249 Acidic fraction
1669 30 52 2 0 0 5 444.416 0.000211 Acidic fraction
1670 27 54 2 0 0 1 410.432 0.000221 Acidic fraction
1671 30 54 1 0 0 4 430.432 0.000131 Acidic fraction
1672 28 54 2 0 0 2 422.432 0.000501 Acidic fraction
1673 29 54 2 0 0 3 434.432 0.00042 Acidic fraction
1674 30 54 2 0 0 4 446.432 0.000252 Acidic fraction
1675 31 54 2 0 0 5 458.432 0.000225 Acidic fraction
1676 28 56 2 0 0 1 424.448 0.000319 Acidic fraction
1677 31 56 1 0 0 4 444.448 0.000124 Acidic fraction
1678 29 56 2 0 0 2 436.448 0.000201 Acidic fraction
1679 30 56 2 0 0 3 448.448 0.000336 Acidic fraction
1680 31 56 2 0 0 4 460.448 0.000288 Acidic fraction
1681 32 56 2 0 0 5 472.448 0.000204 Acidic fraction
1682 32 58 1 0 0 4 458.464 0.000118 Acidic fraction
1683 31 58 2 0 0 3 462.464 0.000271 Acidic fraction
1684 32 58 2 0 0 4 474.464 0.000172 Acidic fraction
1685 32 60 2 0 0 3 476.48 0.000186 Acidic fraction
1686 33 60 2 0 0 4 488.48 0.000248 Acidic fraction
1687 33 62 2 0 0 3 490.496 0.000145 Acidic fraction
1688 34 62 2 0 0 4 502.496 0.000184 Acidic fraction
1689 34 64 2 0 0 3 504.512 0.000245 Acidic fraction